Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 7/20 | 0.59 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL20984777 | 0.83 | KDM4E (0.59) | CRHR1CYP3A4P2RX7ALDH1A1CYP1A2 | |
| SCHEMBL9462103 | 0.83 | CRHR1 (0.54) | CRHR1CYP3A4P2RX7ALDH1A1CYP1A2 | |
| SCHEMBL14691078 | 0.82 | ALDH1A1 (0.46) | CRHR1CA1CA2CA9CYP3A4 | |
| SCHEMBL11427661 | 0.82 | CRHR1 (0.54) | CRHR1P2RX7ALDH1A1HTTMEN1 | |
| SCHEMBL5770020 | 0.80 | CRHR1 (0.52) | CRHR1P2RX7ALDH1A1CYP1A2HPGD | |
| SCHEMBL19568160 | 0.80 | CRHR1 (0.51) | CRHR1P2RX7ALDH1A1CYP1A2HPGD | |
| SCHEMBL646296 | 0.79 | HPGD (0.66) | ALDH1A1CYP1A2HPGDCYP2C19HTT | |
| SCHEMBL29524654 | 0.79 | HPGD (0.66) | ALDH1A1CYP1A2HPGDCYP2C19HTT | |
| SCHEMBL9153331 | 0.78 | ALDH1A1 (0.59) | CA1CA2CA9CYP3A4ALOX5 | |
| SCHEMBL10942883 | 0.78 | CA1 (0.61) | CA1CA2CA9CYP3A4ALOX5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016092559-A1 | SUBSTITUTED PYRAZOLE DERIVATIVES HAVING ACTIVITY AS FUNGICIDES | OAT & IIL INDIA LABORATORIES PRIVATE LIMITED (IN) | 2016-06-16 | — | — | WO | disclosed |