Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.44 |
| ▸ | VNN1 | O95497 | 2/20 | 0.39 |
| ▸ | PDE5A | O76074 | 6/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.35 |
| ▸ | KLK1 | P06870 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4351839 | 0.82 | HDAC8 (0.45) | KDM4EALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL4346813 | 0.80 | KMT2A (0.48) | KDM4EALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6566872 | 0.77 | CA1 (0.51) | LOXL2ALDH1A1CYP1A2CYP2C9HPGD | |
| SCHEMBL4345563 | 0.76 | BRD4 (0.49) | CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL6566907 | 0.75 | POLB (0.50) | KDM4EALDH1A1HPGDLMNAHTT | |
| SCHEMBL4355634 | 0.74 | MAPT (0.56) | KDM4EALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL10873553 | 0.72 | LOXL2 (0.49) | LOXL2VNN1MMP2MMP3KDM4E | |
| SCHEMBL4349831 | 0.71 | RXFP1 (0.46) | CYP1A2CYP2D6HPGDCYP2C19LMNA | |
| SCHEMBL6568648 | 0.70 | LMNA (0.41) | KDM4EALDH1A1CYP2C9HPGDLMNA | |
| SCHEMBL4357552 | 0.70 | HDAC8 (0.47) | KDM4EALDH1A1HTTSMN1; SMN2 |
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-1402887-A1 | New compounds for the inhibition of undesired cell proliferation and use thereof | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |
| EP-1402888-A1 | The use of substituted carbocyclic compounds as rotamases inhibitors | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |