Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FABP4 | P15090 | 3/20 | 0.49 |
| ▸ | FABP3 | P05413 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | APAF1 | O14727 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | CASP6 | P55212 | 1/20 | 0.48 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.48 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.48 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.48 |
| ▸ | DHODH | Q02127 | 5/20 | 0.47 |
| ▸ | CDC25B | P30305 | 1/20 | 0.46 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.45 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.45 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.45 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL30294575 | 1.00 | FABP4 (0.49) | FABP4FABP3KDM4EAPAF1RECQL | |
| SCHEMBL22720122 | 0.82 | FABP4 (0.66) | FABP4FABP3KDM4EAPAF1RECQL | |
| SCHEMBL30294291 | 0.81 | LIPC (0.50) | KDM4EDHODHALDH1A1AKR1C3AKR1C2 | |
| SCHEMBL6141067 | 0.81 | FABP4 (0.62) | FABP4FABP3KDM4EAPAF1RECQL | |
| SCHEMBL16489007 | 0.80 | MAPT (0.62) | FABP4FABP3KDM4EAPAF1RECQL | |
| SCHEMBL6141327 | 0.78 | FABP4 (0.62) | FABP4FABP3KDM4EAPAF1RECQL | |
| SCHEMBL22853331 | 0.77 | AKR1C3 (0.59) | FABP4FABP3KDM4EAPAF1RECQL | |
| SCHEMBL30294672 | 0.77 | AKR1C3 (0.59) | FABP4FABP3KDM4EAPAF1RECQL | |
| SCHEMBL16836614 | 0.76 | KEAP1 (0.47) | DHODHPTGDR2 | |
| SCHEMBL21201150 | 0.75 | HTT (0.44) | KDM4EALDH1A1GAACYP2C19PTGDR2 |
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-2020261114-A1 | 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2020-12-30 | — | — | WO | disclosed |