Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 3/20 | 0.48 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | SGK1 | O00141 | 1/20 | 0.43 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CDK8 | P49336 | 1/20 | 0.41 |
| ▸ | FNTA | P49354 | 1/20 | 0.41 |
| ▸ | FNTB | P49356 | 1/20 | 0.41 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.41 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.41 |
| ▸ | AXL | P30530 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4256137 | 0.81 | MMP2 (0.52) | HSD17B1HSD17B2CYP3A4CYP2C9MEN1 | |
| SCHEMBL7394802 | 0.81 | CA1 (0.56) | HSD17B1HSD17B2CYP3A4CYP2C9KDM4E | |
| SCHEMBL7392985 | 0.80 | MMP2 (0.57) | KDM4ELMNAMAPTALDH1A1MEN1 | |
| SCHEMBL1505315 | 0.77 | HSD17B1 (0.46) | HSD17B1HSD17B2CYP3A4CYP2C9KDM4E | |
| SCHEMBL28968146 | 0.76 | CDK8 (0.51) | KDM4ELMNAMAPTCDK8NEK1 | |
| SCHEMBL21873453 | 0.74 | MAPT (0.51) | KDM4ELMNAMAPTALDH1A1MEN1 | |
| SCHEMBL29016894 | 0.74 | NEK1 (0.50) | HSD17B1HSD17B2CYP3A4CYP2C9SGK1 | |
| SCHEMBL4264131 | 0.74 | PLAU (0.52) | CYP3A4MAPTALDH1A1GAAKMT2A | |
| SCHEMBL13949639 | 0.73 | EGFR (0.43) | SGK1CAMKK2KDM4EALDH1A1EGFR | |
| SCHEMBL15051048 | 0.73 | CSNK2A1 (0.68) | CYP3A4CYP2C9KDM4ELMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7179822-B2 | Hetero biaryl derivatives as matrix metalloproteinase inhibitors | WARNER-LAMBERT COMPANY (US) | 2007-02-20 | — | — | US | disclosed |