Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 4/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9332945 | 0.88 | TDP1 (0.48) | CYP3A4TDP1KDM4EGAAESR1 | |
| SCHEMBL9335851 | 0.85 | CYP3A4 (0.50) | CYP3A4TDP1KDM4EGAAESR1 | |
| SCHEMBL9336100 | 0.83 | CYP3A4 (0.48) | CYP3A4TDP1KDM4EGAAESR1 | |
| SCHEMBL14735869 | 0.81 | TDP1 (0.92) | CYP3A4TDP1KDM4EGAAESR1 | |
| SCHEMBL10819825 | 0.78 | KDM4E (0.60) | CYP3A4TDP1KDM4EGAAESR1 | |
| SCHEMBL2085135 | 0.77 | TDP1 (1.00) | CYP3A4TDP1KDM4EGAAESR1 | |
| Benzene SCHEMBL6890099 | 0.77 | TDP1 (1.00) | CYP3A4TDP1KDM4EGAAESR1 | |
| SCHEMBL5028587 | 0.77 | TDP1 (1.00) | CYP3A4TDP1KDM4EGAAESR1 | |
| SCHEMBL101 | 0.77 | TDP1 (1.00) | CYP3A4TDP1KDM4EGAAESR1 | |
| SCHEMBL25384985 | 0.74 | TDP1 (0.92) | CYP3A4TDP1KDM4EGAAESR1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020137820-A1 | Phosphorus compounds | SANDOZ LTD. (CH) | 2002-09-26 | — | — | US | claimed |
| US-6864304-B2 | Phosphorus compounds | CLARIANT FINANCE (BVI) LIMITED (VG) | 2005-03-08 | — | — | US | disclosed |
| US-20020137820-A1 | Phosphorus compounds | SANDOZ LTD. (CH) | 2002-09-26 | — | — | US | disclosed |
| US-6369140-B1 | POLYOLEFIN AND PHOSPHINE OR PHOSPHORANE COMPOUNDS STABILIZERS; OXIDATION, HEAT, STRESS, AND ULTRAVIOLET RADIATION RESISTANCE | CLARIANT FINANCE (BVI) LIMITED (BV) | 2002-04-09 | — | — | US | disclosed |
| US-5488079-A | HEAT AND LIGHT STABILIZERS FOR OLEFINS USING PHOSPHINES | SANDOZ LTD. (CH) | 1996-01-30 | — | — | US | disclosed |
| EP-0499329-B1 | Carbonylation catalyst system | SHELL INT RESEARCH (NL) | 1994-05-04 | — | — | EP | disclosed |
| US-5258546-A | Reaction of acetylene with carbon monoxide for alpha, beta-olefin unsaturated compounds | SHELL OIL COMPANY (US) | 1993-11-02 | — | — | US | disclosed |
| US-5189003-A | Of group 8 metal or compound and a polyphosphine | SHELL OIL COMPANY (US) | 1993-02-23 | — | — | US | disclosed |
| EP-0499329-A1 | Carbonylation catalyst system | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1992-08-19 | — | — | EP | disclosed |