Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.66 |
| ▸ | HTT | P42858 | 1/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | MC4R | P32245 | 2/20 | 0.60 |
| ▸ | USP2 | O75604 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | BCHE | P06276 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL29941835 | 1.00 | HPGD (0.66) | HPGDHTTALDH1A1MC4RUSP2 | |
| SCHEMBL23961740 | 0.84 | HPGD (0.49) | HPGDHTTALDH1A1MC4RUSP2 | |
| SCHEMBL23961742 | 0.84 | HPGD (0.49) | HPGDHTTALDH1A1MC4RUSP2 | |
| SCHEMBL16644094 | 0.82 | PKM (0.67) | HPGDHTTALDH1A1USP2LMNA | |
| SCHEMBL27788415 | 0.81 | PKM (0.61) | HPGDHTTALDH1A1MC4RUSP2 | |
| SCHEMBL19974823 | 0.81 | RXFP1 (0.57) | RAB9A | |
| SCHEMBL8410430 | 0.79 | TSHR (0.55) | HPGDHTTALDH1A1MC4RUSP2 | |
| SCHEMBL8413516 | 0.79 | TSHR (0.55) | HPGDHTTALDH1A1MC4RUSP2 | |
| SCHEMBL8410423 | 0.79 | TSHR (0.55) | HPGDHTTALDH1A1MC4RUSP2 | |
| SCHEMBL2447399 | 0.79 | MC4R (0.60) | HPGDHTTALDH1A1MC4RUSP2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5556874-A | ENZYME INHIBITORS AS ANTICARCINOGENIC AGENTS | WARNER LAMBERT COMPANY (US) | 1996-09-17 | — | — | US | disclosed |
| US-5464861-A | Anticarcinogenic agents | WARNER-LAMBERT (US) | 1995-11-07 | — | — | US | disclosed |
| EP-0654024-A1 | 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES | WARNER-LAMBERT COMPANY (US) | 1995-05-24 | — | — | EP | disclosed |
| WO-1994003427-A1 | 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES | WARNER-LAMBERT COMPANY (US) | 1994-02-17 | — | — | WO | disclosed |