Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | RAF1 | P04049 | 1/20 | 0.42 |
| ▸ | BRAF | P15056 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | C1R | P00736 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14591741 | 0.89 | NPC1 (0.42) | NPC1RAB9ARAF1BRAFPDE4D | |
| SCHEMBL14626736 | 0.88 | NPC1 (0.48) | NPC1RAB9ARAF1BRAFHPGD | |
| SCHEMBL14500949 | 0.85 | NPC1 (0.45) | NPC1RAB9ARAF1BRAFPDE4D | |
| SCHEMBL14592378 | 0.83 | NPC1 (0.43) | NPC1RAB9ARAF1BRAFPDE4D | |
| SCHEMBL2432634 | 0.80 | GAA (0.45) | NPC1RAB9AP2RX7C1RSMN1; SMN2 | |
| SCHEMBL2432858 | 0.80 | NPC1 (0.43) | NPC1RAB9AHPGDMAPTP2RX7 | |
| SCHEMBL14591738 | 0.78 | NPC1 (0.41) | NPC1RAB9AP2RX7C1RSMN1; SMN2 | |
| SCHEMBL6601852 | 0.78 | KDR (0.42) | NPC1RAB9AHPGDMAPTPOLB | |
| SCHEMBL14591750 | 0.77 | NPC1 (0.45) | NPC1RAB9ARAF1BRAFHPGD | |
| SCHEMBL6594730 | 0.77 | MAPT (0.41) | NPC1RAB9AHPGDMAPTSMN1; SMN2 |
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-7157487-B2 | Vla-4 inhibitors | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2007-01-02 | — | — | US | disclosed |