Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.47 |
| ▸ | TAS2R14 | Q9NYV8 | 2/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.44 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.44 |
| ▸ | ELANE | P08246 | 1/20 | 0.44 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.44 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL9412348 | 0.86 | CA1 (0.52) | KMT2AFAAHPRSS1PRSS2ELANE | |
| SCHEMBL776229 | 0.81 | MAPT (0.61) | KMT2AEGFRERBB2HSD11B1TAS2R14 | |
| SCHEMBL8378392 | 0.77 | HTT (0.51) | KMT2AEGFRERBB2HSD11B1TAS2R14 | |
| SCHEMBL9412344 | 0.74 | CA9 (0.53) | KMT2AFAAHPRSS1PRSS2ELANE | |
| SCHEMBL7938372 | 0.72 | HTR2A (0.58) | EGFRERBB2HSD11B1TAS2R14PKM | |
| SCHEMBL422010 | 0.71 | USP2 (0.51) | KMT2AEGFRERBB2FAAHPRSS1 | |
| SCHEMBL776873 | 0.69 | CA2 (0.47) | KMT2AEGFRERBB2HSD11B1TAS2R14 | |
| SCHEMBL4663044 | 0.69 | KEAP1 (0.76) | KMT2AEGFRERBB2PKMTAAR1 | |
| SCHEMBL9421733 | 0.69 | FAAH (0.62) | KMT2AEGFRERBB2FAAHPRSS1 | |
| SCHEMBL778229 | 0.69 | HTR6 (0.70) | KMT2AHSD11B1PKMHTR2AHTR2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0960104-A1 | N-(AMIDINOPHENYL)-N'-(SUBST.)-3H-2,4-BENZODIAZEPIN-3-ONE DERIVATIVES AS FACTOR XA INHIBITORS | Du Pont Pharmaceuticals Company (US) | 1999-12-01 | — | — | EP | disclosed |
| WO-1997038984-A1 | N-(AMIDINOPHENYL)-N'-(SUBST.)-3H-2,4-BENZODIAZEPIN-3-ONE DERIVATIVES AS FACTOR XA INHIBITORS | DU PONT PHARMACEUTICALS COMPANY (US) | 1997-10-23 | — | — | WO | disclosed |