Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | PLA2G1B | P04054 | 2/20 | 0.42 |
| ▸ | ATG4B | Q9Y4P1 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GID4 | Q8IVV7 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7397444 | 1.00 | KMT2A (0.43) | KMT2ANPC1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL3968975 | 0.88 | MCL1 (0.44) | KMT2ANPC1RAB9AHPGDMEN1 | |
| SCHEMBL556016 | 0.88 | MCL1 (0.44) | KMT2ANPC1RAB9AHPGDMEN1 | |
| SCHEMBL13939605 | 0.88 | MCL1 (0.44) | KMT2ANPC1RAB9AHPGDMEN1 | |
| SCHEMBL14257387 | 0.79 | L3MBTL1 (0.44) | KMT2ANPC1CYP2C9RAB9AL3MBTL1 | |
| SCHEMBL3649344 | 0.79 | KMT2A (0.47) | KMT2ANPC1RAB9APLA2G1BATG4B | |
| SCHEMBL14257396 | 0.79 | EPHX1 (0.47) | HTTLMNA | |
| SCHEMBL14257322 | 0.79 | EPHX1 (0.50) | CYP1A2CYP2C9CYP2C19HTTLMNA | |
| SCHEMBL24090836 | 0.78 | MAPK14 (0.50) | KMT2ANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL3281978 | 0.77 | FAAH (0.58) | NPC1CYP1A2CYP2D6CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002064211-A1 | THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2002-08-22 | — | — | WO | disclosed |