Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.65 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.51 |
| ▸ | SLC9A1 | P19634 | 6/20 | 0.50 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.49 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.48 |
| ▸ | HTR2A | P28223 | 2/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9137840 | 0.89 | CYP2D6 (0.79) | CYP2D6P2RX7SLC9A1EGLN3NPC1 | |
| SCHEMBL4340679 | 0.83 | CYP2D6 (0.74) | CYP2D6SLC9A1EGLN3NPC1MAPT | |
| SCHEMBL14523150 | 0.82 | KDM4E (0.47) | CYP2D6P2RX7SLC9A1ADRA1DHTR2A | |
| SCHEMBL10625061 | 0.81 | CYP2D6 (0.72) | CYP2D6SLC9A1NPC1MAPTRAB9A | |
| SCHEMBL2936169 | 0.81 | SLC9A1 (0.68) | SLC9A1EGLN3NPC1MAPTRAB9A | |
| SCHEMBL2491350 | 0.79 | CYP2D6 (1.00) | CYP2D6SLC9A1NPC1MAPTRAB9A | |
| SCHEMBL11208551 | 0.79 | CYP2D6 (0.68) | CYP2D6SLC9A1NPC1MAPTRAB9A | |
| SCHEMBL31234269 | 0.77 | SLC9A1 (0.70) | CYP2D6SLC9A1EGLN3NPC1MAPT | |
| SCHEMBL1774497 | 0.77 | SLC9A1 (0.70) | CYP2D6SLC9A1EGLN3NPC1MAPT | |
| SCHEMBL9341979 | 0.76 | SLC9A1 (0.63) | CYP2D6SLC9A1EGLN3NPC1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4177155-A | N-AMINOMETHYL-TRIAZOLES AND IMIDAZOLES FOR MAKING ANTIFREEZES NONCORROSIVE | CIBA-GEIGY CORPORATION (US) | 1979-12-04 | — | — | US | claimed |
| US-4177155-A | N-AMINOMETHYL-TRIAZOLES AND IMIDAZOLES FOR MAKING ANTIFREEZES NONCORROSIVE | CIBA-GEIGY CORPORATION (US) | 1979-12-04 | — | — | US | disclosed |