Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.41 |
| ▸ | PGK1 | P00558 | 1/20 | 0.40 |
| ▸ | PGK2 | P07205 | 1/20 | 0.40 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6666487 | 0.82 | PTPN1 (0.50) | CES1PTPN1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL354556 | 0.82 | CYP1A2 (0.52) | CES1PTPN1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL30274469 | 0.80 | CYP1A2 (0.50) | CES1PTPN1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL887042 | 0.80 | CYP1A2 (0.50) | CES1PTPN1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL3243938 | 0.80 | PTPN1 (0.48) | CES1PTPN1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL11205832 | 0.80 | PTPN1 (0.48) | CES1PTPN1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL2465581 | 0.78 | MAPT (0.56) | CES1PTPN1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL28345620 | 0.78 | PTPN1 (0.46) | CES1PTPN1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL31026233 | 0.78 | CES1 (0.48) | CES1PTPN1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL247104 | 0.78 | CYP1A2 (0.48) | CES1PTPN1ALDH1A1TSHRCYP1A2 |
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-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |