Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TRPC1 | P48995 | 1/20 | 0.39 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.39 |
| ▸ | STIM1 | Q13586 | 1/20 | 0.39 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.39 |
| ▸ | STIM2 | Q9P246 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL2856355 | 0.92 | RAB9A (0.52) | NPC1PKMRAB9AMAPTNPY5R | |
| SCHEMBL2852361 | 0.91 | KDM4E (0.47) | CYP1A2NPC1PKMRAB9AMAPT | |
| SCHEMBL2850809 | 0.90 | MAPT (0.43) | RAB9AMAPTKMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2852552 | 0.90 | MEN1 (0.51) | NPC1RAB9AMAPTKMT2APOLB | |
| SCHEMBL2853465 | 0.89 | RAB9A (0.44) | NPC1RAB9AMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL2852353 | 0.89 | RAB9A (0.44) | CYP1A2CYP3A4CYP2D6CYP2C19RAB9A | |
| SCHEMBL2858515 | 0.89 | MAPT (0.44) | MAPTPOLBSMN1; SMN2ALDH1A1TRPC1 | |
| SCHEMBL2848541 | 0.89 | RAB9A (0.43) | NPC1RAB9AMAPTKMT2APOLB | |
| SCHEMBL2854596 | 0.89 | TP53 (0.46) | CYP1A2CYP3A4CYP2C19MAPTKMT2A | |
| SCHEMBL2850610 | 0.88 | MAPT (0.40) | MAPTKMT2APOLBSMN1; SMN2ALDH1A1 |
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 |