Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PEPD | P12955 | 1/20 | 0.77 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.62 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | GLA | P06280 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | ESR1 | P03372 | 1/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | GFER | P55789 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL1322717 | 0.88 | PEPD (1.00) | PEPDALDH1A1GLACYP3A4MEN1 | |
| SCHEMBL5528916 | 0.85 | SMN1; SMN2 (0.66) | HSD17B10PARP10ALDH1A1HPGDGAA | |
| SCHEMBL17628546 | 0.84 | MAOA (0.64) | PEPDMEN1KMT2AESR1ESR2 | |
| SCHEMBL4092732 | 0.83 | NPC1 (0.78) | PEPDHSD17B10ALDH1A1GLACYP3A4 | |
| SCHEMBL13750226 | 0.83 | KIF11 (0.70) | PEPDHSD17B10ALDH1A1GLACYP3A4 | |
| SCHEMBL5008975 | 0.81 | HSD17B10 (0.58) | PEPDHSD17B10ALDH1A1GLACYP3A4 | |
| SCHEMBL2844063 | 0.81 | KMT2A (0.77) | ALDH1A1CYP3A4HPGDMEN1KMT2A | |
| SCHEMBL5062623 | 0.78 | PEPD (0.80) | PEPDHSD17B10ALDH1A1GLAMEN1 | |
| SCHEMBL11831801 | 0.78 | MEN1 (0.77) | HSD17B10ALDH1A1MEN1KMT2AGAA | |
| SCHEMBL21550458 | 0.77 | PEPD (0.77) | PEPDALDH1A1GLACYP3A4MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1047418-A4 | INHIBITION OF RAF KINASE USING SUBSTITUTED HETEROCYCLIC UREAS | BAYER AG (US) | 2001-02-07 | — | — | EP | claimed |
| EP-1047418-A1 | INHIBITION OF RAF KINASE USING SUBSTITUTED HETEROCYCLIC UREAS | Bayer Corporation (US) | 2000-11-02 | — | — | EP | claimed |
| WO-1999032106-A1 | INHIBITION OF RAF KINASE USING SUBSTITUTED HETEROCYCLIC UREAS | BAYER CORPORATION (US) | 1999-07-01 | — | — | WO | claimed |