Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.37 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7101464 | 0.83 | CALCA (0.51) | TDP1KDM4EMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL4076243 | 0.72 | KDM4E (0.40) | KDM4ENPC1HSP90AA1RAB9AALDH1A1 | |
| SCHEMBL16296072 | 0.69 | TDP1 (0.44) | TDP1LMNAKDM4ECYP17A1TRIM24 | |
| SCHEMBL7258267 | 0.68 | KDM4E (0.53) | TDP1LMNAKDM4EGLO1NPC1 | |
| SCHEMBL7101459 | 0.68 | KMT2A (0.42) | LMNAKDM4EGLO1MEN1KMT2A | |
| SCHEMBL6646416 | 0.65 | KDM4E (0.49) | TDP1LMNAKDM4EMEN1KMT2A | |
| SCHEMBL4071983 | 0.65 | KDM4E (0.56) | TDP1LMNAKDM4EGLO1MEN1 | |
| SCHEMBL4076247 | 0.65 | KDM4E (0.41) | TDP1KDM4EMEN1KMT2AHSP90AA1 | |
| SCHEMBL4764998 | 0.65 | CALCA (0.54) | LMNAKDM4EHSP90AA1RAB9AALDH1A1 | |
| SCHEMBL4765018 | 0.65 | CALCA (0.52) | LMNAKDM4EHSP90AA1ALDH1A1HTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1326865-A2 | AZA- AND POLYAZA-NAPHTHALENYL CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (US) | 2003-07-16 | — | — | EP | disclosed |
| WO-2002030930-A2 | AZA- AND POLYAZA-NAPHTHALENYL CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 2002-04-18 | — | — | WO | disclosed |