Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.53 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | PLAU | P00749 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL18774006 | 0.83 | HSD17B2 (0.60) | HSD17B2HSD17B1TDP1HPGDHSD17B10 | |
| SCHEMBL2462295 | 0.83 | HSD17B2 (0.59) | KMT2AL3MBTL1NPC1RAB9AHSD17B2 | |
| SCHEMBL15676799 | 0.82 | CYP1A2 (0.46) | MEN1KMT2AL3MBTL1NPC1RAB9A | |
| SCHEMBL1696607 | 0.80 | PLAU (0.43) | MEN1KMT2AL3MBTL1NPC1RAB9A | |
| SCHEMBL29940968 | 0.80 | HSD17B2 (0.72) | KMT2ANPC1RAB9AHSD17B2HSD17B1 | |
| SCHEMBL10212283 | 0.80 | HSD17B2 (0.72) | KMT2ANPC1RAB9AHSD17B2HSD17B1 | |
| SCHEMBL18773991 | 0.79 | TP53 (0.62) | MEN1KMT2ANPC1RAB9AHSD17B2 | |
| SCHEMBL23367854 | 0.79 | GPBAR1 (0.55) | MEN1KMT2AL3MBTL1NPC1RAB9A | |
| SCHEMBL15705637 | 0.79 | PLAU (0.50) | MEN1KMT2ANPC1RAB9AHSD17B2 | |
| SCHEMBL18773818 | 0.79 | SMN1; SMN2 (0.55) | NPC1RAB9AHSD17B2HSD17B1TDP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1773786-B1 | FIVE-MEMBERED HETEROCYCLES USEFUL AS SERINE PROTEASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2017-04-26 | — | — | EP | disclosed |