Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6202381 | 0.81 | SLC6A2 (0.41) | CYP1A2CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL6204860 | 0.73 | TSHR (0.47) | POLBCYP1A2ALDH1A1TAAR1 | |
| SCHEMBL17055847 | 0.71 | KDM4E (0.53) | KDM4EPOLBKMT2AAKR1B1SMN1; SMN2 | |
| SCHEMBL6204365 | 0.71 | AKR1B1 (0.39) | KDM4EPOLBKMT2AAKR1B1SMN1; SMN2 | |
| Ether SCHEMBL27465042 | 0.69 | KDM4E (0.47) | KDM4EPOLBCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6201896 | 0.68 | IDO1 (0.38) | KDM4EPOLBCYP3A4KMT2AALDH1A1 | |
| SCHEMBL9780828 | 0.68 | KMT2A (0.49) | KDM4EPOLBCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9780837 | 0.68 | KMT2A (0.49) | KDM4EPOLBCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL18537078 | 0.67 | TAAR1 (0.41) | POLBCYP1A2CYP3A4NPSR1AKR1B1 | |
| SCHEMBL4486331 | 0.67 | ALDH1A1 (0.32) | ALDH1A1 |
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-1506175-A1 | N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-02-16 | — | — | EP | disclosed |
| WO-2003097609-A1 | N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2003-11-27 | — | — | WO | disclosed |