Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | CCR1 | P32246 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2856483 | 0.81 | ALDH1A1 (0.45) | ALDH1A1KDM4EMAPTSMN1; SMN2POLB | |
| SCHEMBL2855547 | 0.78 | TAAR1 (0.54) | ALDH1A1KDM4EMAPTSMN1; SMN2POLB | |
| SCHEMBL2852844 | 0.78 | LIPE (0.45) | ALDH1A1KDM4EMAPTSMN1; SMN2POLB | |
| SCHEMBL2856944 | 0.78 | TAAR1 (0.46) | ALDH1A1KDM4EMAPTSMN1; SMN2POLB | |
| SCHEMBL2853388 | 0.76 | CCR1 (0.48) | ALDH1A1KDM4EMAPTSMN1; SMN2POLB | |
| SCHEMBL2859861 | 0.74 | TAAR1 (0.51) | ALDH1A1KDM4EMAPTSMN1; SMN2POLB | |
| SCHEMBL2859611 | 0.74 | CCR1 (0.53) | KDM4EMAPTCCR1NPSR1HSP90AA1 | |
| SCHEMBL5324620 | 0.73 | MAPT (0.48) | ALDH1A1KDM4EMAPTSMN1; SMN2POLB | |
| SCHEMBL2856892 | 0.73 | CCR1 (0.40) | ALDH1A1KDM4EMAPTSMN1; SMN2POLB | |
| SCHEMBL2860669 | 0.73 | TAAR1 (0.46) | ALDH1A1KDM4EMAPTCCR1LMNA |
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 |