Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.35 |
| ▸ | KDM5A | P29375 | 3/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.35 |
| ▸ | KDM5B | Q9UGL1 | 3/20 | 0.35 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21177620 | 0.74 | CYP1A2 (0.38) | CYP1A2CYP2D6ALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL15785575 | 0.73 | KMO (0.36) | KDM5AKDM4CKDM5B | |
| SCHEMBL21177290 | 0.71 | CYP1A2 (0.36) | CYP1A2CYP2D6ALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL21179381 | 0.71 | ELOVL1 (0.32) | CYP1A2CYP2D6ALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL21177704 | 0.68 | KMO (0.38) | CYP1A2CYP2D6ALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL9970890 | 0.68 | CYP1A2 (0.38) | CYP1A2CYP2D6ALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL7717522 | 0.66 | CYP1A2 (0.50) | CYP1A2CYP2D6ALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL22894827 | 0.65 | RECQL (0.44) | KDM5AKDM4CKDM5B | |
| SCHEMBL19154950 | 0.65 | KDM4C (0.40) | KDM5AKDM4CKDM5B | |
| SCHEMBL15359978 | 0.65 | CYP2C19 (0.58) | CYP1A2ALDH1A1CYP2C19HSD17B10ELOVL1 |
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-2019141957-A1 | N-PYRIMIDINYL HYDROXY PYRAZOLE DERIVATIVES AND USES THEREOF | CADO BIOTECHNOLOGY IVS (DK) | 2019-07-25 | — | — | WO | disclosed |