Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | BLM | P54132 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | METAP1 | P53582 | 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 | |
|---|---|---|---|---|
| SCHEMBL9183270 | 0.90 | ALDH1A1 (0.44) | CYP2D6CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL2702055 | 0.82 | ALDH1A1 (0.43) | CYP2D6CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL890760 | 0.82 | NOS3 (0.35) | CYP2D6CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL8802907 | 0.80 | CYP2D6 (0.33) | CYP2D6CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL28247026 | 0.78 | CYP2D6 (0.40) | CYP2D6CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL114270 | 0.78 | CYP2D6 (0.48) | CYP2D6CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL28205435 | 0.78 | CYP2D6 (0.40) | CYP2D6CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL27515999 | 0.78 | CYP2D6 (0.40) | CYP2D6CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL6170890 | 0.78 | HTT (0.33) | CYP2D6CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL12213331 | 0.78 | ALDH1A1 (0.33) | CYP2D6CYP2C19RAB9AALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |