Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 5/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2852370 | 0.91 | ALDH1A1 (0.52) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL2848518 | 0.88 | ALDH1A1 (0.58) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL2856388 | 0.86 | TRPV1 (0.51) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL2854686 | 0.86 | SMN1; SMN2 (0.52) | ALDH1A1HTTSMN1; SMN2POLBHPGD | |
| SCHEMBL2861682 | 0.84 | ALDH1A1 (0.48) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL2863326 | 0.83 | TP53 (0.53) | ALDH1A1HTTKDM4ESMN1; SMN2HPGD | |
| SCHEMBL2857977 | 0.83 | ALDH1A1 (0.47) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL2850427 | 0.83 | SMN1; SMN2 (0.60) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL2854333 | 0.83 | RAB9A (0.52) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL2850346 | 0.83 | SMN1; SMN2 (0.48) | ALDH1A1HTTKDM4ESMN1; SMN2POLB |
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 |