Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.63 |
| ▸ | CD44 | P16070 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | S100B | P04271 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29739694 | 0.91 | GAA (0.69) | GAACD44NPC1POLBL3MBTL1 | |
| SCHEMBL5438387 | 0.91 | GAA (0.69) | GAACD44NPC1POLBL3MBTL1 | |
| SCHEMBL9416808 | 0.84 | GAA (0.78) | GAACD44NPC1POLBL3MBTL1 | |
| SCHEMBL4388470 | 0.83 | NPC1 (0.63) | GAACD44NPC1POLBL3MBTL1 | |
| SCHEMBL29466462 | 0.82 | GAA (0.83) | GAANPC1POLBL3MBTL1ALDH1A1 | |
| SCHEMBL92067 | 0.82 | GAA (0.83) | GAANPC1POLBL3MBTL1ALDH1A1 | |
| SCHEMBL8233721 | 0.81 | GLA (0.53) | GAACD44NPC1POLBL3MBTL1 | |
| SCHEMBL29587813 | 0.81 | GLA (0.53) | GAACD44NPC1POLBL3MBTL1 | |
| SCHEMBL8080817 | 0.81 | L3MBTL1 (0.56) | GAANPC1POLBL3MBTL1ALDH1A1 | |
| Acetoacetic Acid SCHEMBL11805353 | 0.81 | ALDH1A1 (0.45) | GAACD44NPC1POLBL3MBTL1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 211 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1773768-B1 | PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | EXELIXIS INC (US) | 2018-08-22 | — | — | EP | claimed |
| EP-1668082-B1 | LAKED AZO RED PIGMENT AND PROCESSES FOR PREPARATION AND USE | BASF CATALYSTS LLC (US) | 2013-01-09 | — | — | EP | claimed |
| EP-1773768-A4 | PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | EXELIXIS INC (US) | 2008-08-06 | — | — | EP | claimed |
| EP-1773768-A2 | PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | Exelixis, Inc. (US) | 2007-04-18 | — | — | EP | claimed |
| EP-1668081-A1 | HEAT STABLE LAKED MONOAZO RED PIGMENT | ENGELHARD CORPORATION (US) | 2006-06-14 | — | — | EP | claimed |
| EP-1668082-A1 | LAKED AZO RED PIGMENT AND PROCESSES FOR PREPARATION AND USE | Engelhard Corporation (US) | 2006-06-14 | — | — | EP | claimed |
| US-7041421-B2 | Laked azo red pigment and processes for preparation and use | ENGELHARD CORPORATION (US) | 2006-05-09 | — | — | US | claimed |
| WO-2006012642-A2 | PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | EXELIXIS, INC. (US) | 2006-02-02 | — | — | WO | claimed |
| US-6902612-B2 | Heat stable laked monoazo red pigment | ENGELHARD CORPORATION (US) | 2005-06-07 | — | — | US | claimed |
| WO-2005026265-A1 | LAKED AZO RED PIGMENT AND PROCESSES FOR PREPARATION AND USE | ENGELHARD CORPORATION (US) | 2005-03-24 | — | — | WO | claimed |
| US-6417195-B1 | LIBRARIES AND COMBINATORIAL CHEMISTRY | LION BIOSCIENCE AG (DE) | 2002-07-09 | — | — | US | claimed |
| US-6372030-B1 | INK VEHICLE SELECTED FROM 4-(HEXADECYLAMINO)BENZYLAMINE, N-OCTANOYL-N-METHYL GLUCAMINE, OCTANOIC HYDRAZIDE, 4-HEXADECYL SULFONYL ANILINE, A CONDUCTIVE COMPLEX OF AN AMINE COMPOUND WITH A PHOSPHORUS OR SULFUR-CONTAINING ACID | XEROX CORPORATION | 2002-04-16 | — | — | US | claimed |
| EP-1155001-A1 | ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES | TREGA BIOSCIENCES, INC. (US) | 2001-11-21 | — | — | EP | claimed |
| WO-2000050406-A1 | ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES | LION BIOSCIENCE AG (DE) | 2000-08-31 | — | — | WO | claimed |
| US-5972316-A | UV protection compositions | THE PROCTER & GAMBLE COMPANY (US) | 1999-10-26 | — | — | US | claimed |
| EP-0863877-A4 | ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES | TORREY PINES INST (US) | 1999-07-21 | — | — | EP | claimed |
| US-5874443-A | BIOSYNTHESIS | TREGA BIOSCIENCES, INC. (US) | 1999-02-23 | — | — | US | claimed |
| EP-0863877-A1 | ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES | TORREY PINES INSTITUTE FOR MOLECULAR STUDIES (US) | 1998-09-16 | — | — | EP | claimed |
| WO-1997016428-A1 | ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES | TORREY PINES INSTITUTE FOR MOLECULAR STUDIES (US) | 1997-05-09 | — | — | WO | claimed |
| US-4288362-A | Monoazo pigments containing a quinazo linonylacetoacetanilide coupling component | BAYER AKTIENGESELLSCHAFT (DE) | 1981-09-08 | — | — | US | claimed |