Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.38 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.38 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.37 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.37 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25794336 | 0.71 | NPC1 (0.48) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL13518994 | 0.71 | KDR (0.54) | NPC1RAB9ASMN1; SMN2GAAPARP1 | |
| SCHEMBL6421762 | 0.71 | KDR (0.49) | NPC1RAB9ASMN1; SMN2GAAMEN1 | |
| SCHEMBL20169438 | 0.70 | GAA (0.45) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL27538197 | 0.68 | SMN1; SMN2 (0.50) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL2148037 | 0.68 | ALDH1A1 (0.52) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL20593359 | 0.67 | PSEN1 (0.39) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL26092475 | 0.66 | MEN1 (0.55) | NPC1RAB9ASMN1; SMN2HTR2CPARP1 | |
| SCHEMBL29235094 | 0.66 | NPC1 (0.61) | NPC1RAB9ASMN1; SMN2GAAMAPK1 | |
| SCHEMBL1488412 | 0.65 | KMT2A (0.60) | NPC1RAB9ASMN1; SMN2GAAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9975891-B2 | Lactam-containing compounds and derivatives thereof as factor Xa inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-05-22 | — | — | US | disclosed |