Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11640904 | 0.92 | ALDH1A1 (0.54) | ALDH1A1LMNAAGTR1SMN1; SMN2RAB9A | |
| SCHEMBL11642321 | 0.89 | TSHR (0.51) | ALDH1A1LMNAAGTR1NPSR1SMN1; SMN2 | |
| SCHEMBL11637624 | 0.84 | SMN1; SMN2 (0.52) | ALDH1A1LMNAAGTR1NPSR1SMN1; SMN2 | |
| SCHEMBL11642826 | 0.84 | RAB9A (0.50) | ALDH1A1LMNAAGTR1SMN1; SMN2RAB9A | |
| SCHEMBL11642913 | 0.84 | RAB9A (0.50) | ALDH1A1LMNAAGTR1SMN1; SMN2RAB9A | |
| SCHEMBL11641612 | 0.83 | ALDH1A1 (0.52) | ALDH1A1LMNAAGTR1RAB9AMAPK1 | |
| SCHEMBL11642004 | 0.83 | RAB9A (0.53) | ALDH1A1NPSR1SMN1; SMN2RAB9AMAPK1 | |
| SCHEMBL11639938 | 0.81 | MAPK1 (0.45) | ALDH1A1LMNAAGTR1SMN1; SMN2RAB9A | |
| SCHEMBL11644113 | 0.81 | NPSR1 (0.53) | ALDH1A1LMNANPSR1CYP3A4CYP2C9 | |
| SCHEMBL28490932 | 0.78 | ALDH1A1 (0.76) | ALDH1A1LMNAAGTR1NPSR1RAB9A |
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-4125538-A | ANALGESIC, ANTITUSSIVE | BRISTOL-MYERS COMPANY (US) | 1978-11-14 | — | — | US | disclosed |