Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 8/20 | 0.80 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | F10 | P00742 | 1/20 | 0.55 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.55 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.55 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.55 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.54 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.51 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL27702846 | 0.84 | AKR1C3 (0.91) | AKR1C3HDAC2HDAC8HDAC6MAPK1 | |
| SCHEMBL2850433 | 0.82 | MAPK1 (0.65) | AKR1C3HDAC2HDAC8HDAC6MAPK1 | |
| SCHEMBL2858653 | 0.82 | PRMT1 (0.75) | AKR1C3TBXA2RPRMT1ALDH1A1 | |
| SCHEMBL5035260 | 0.81 | AKR1C3 (0.63) | AKR1C3HDAC2HDAC8HDAC6MAPK1 | |
| SCHEMBL5034887 | 0.79 | CYP2C19 (0.76) | AKR1C3HDAC2HDAC8HDAC6MAPK1 | |
| SCHEMBL1287386 | 0.79 | AKR1C3 (0.70) | AKR1C3HDAC2HDAC8HDAC6TDP1 | |
| SCHEMBL4672142 | 0.79 | AKR1C3 (0.70) | AKR1C3HDAC2HDAC8HDAC6TBXA2R | |
| SCHEMBL17713153 | 0.77 | CYP2C19 (0.53) | AKR1C3HDAC2HDAC8HDAC6MAPK1 | |
| SCHEMBL5032437 | 0.77 | HDAC2 (0.73) | AKR1C3HDAC2HDAC8HDAC6MAPK1 | |
| SCHEMBL8798995 | 0.76 | LMNA (0.55) | AKR1C3MAPK1KMT2ATDP1HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | disclosed |