Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9198640 | 0.84 | PPARA (0.38) | KMT2AALDH1A1MAPK1TDP1L3MBTL1 | |
| SCHEMBL6133961 | 0.83 | GSK3B (0.48) | KMT2AALDH1A1MAPK1TDP1L3MBTL1 | |
| SCHEMBL15003979 | 0.83 | HSD17B3 (0.45) | KMT2AALDH1A1MAPK1TDP1L3MBTL1 | |
| SCHEMBL9197903 | 0.82 | ALDH1A1 (0.43) | KMT2AALDH1A1 | |
| SCHEMBL9193384 | 0.82 | CYP2D6 (0.45) | ALDH1A1KDM4E | |
| SCHEMBL9841175 | 0.81 | ALDH1A1 (0.43) | KMT2AALDH1A1MAPK1TDP1L3MBTL1 | |
| SCHEMBL4285053 | 0.81 | GSK3B (0.50) | KMT2AALDH1A1MAPK1TDP1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL9722613 | 0.80 | ALDH1A1 (0.43) | KMT2AALDH1A1MAPK1TDP1L3MBTL1 | |
| SCHEMBL27931887 | 0.80 | MEN1 (0.49) | KMT2AALDH1A1MAPK1TDP1L3MBTL1 | |
| SCHEMBL27913968 | 0.80 | HTT (0.44) | KMT2AALDH1A1MAPK1MEN1SMN1; SMN2 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3356387-B1 | ANTIMICROBIAL POLYMYXIN DERIVATIVE COMPOUNDS | UNIV MONASH (AU) | 2024-06-26 | — | — | EP | disclosed |
| CN-101932570-B | TRPV1 antagonists and uses thereof | PURDUE PHARMA LP | 2014-11-26 | — | — | CN | disclosed |
| CN-101932570-A | The TRPV1 antagonist with and uses thereof | SHIONOGI & CO | 2010-12-29 | — | — | CN | disclosed |
| EP-0299277-B1 | Process for the preparation of substituted pyridyl-alkyl ketones | BAYER AG (DE) | 1995-10-18 | — | — | EP | disclosed |
| US-4990620-A | Halogen substituted pyridylalkyl ketones | BAYER AKTIENGESELLSCHAFT (DE) | 1991-02-05 | — | — | US | disclosed |
| US-4927938-A | Halogen substituted pyridylalkyl ketones | BAYER AKTIENGESELLSCHAFT (DE) | 1990-05-22 | — | — | US | disclosed |
| EP-0299277-A2 | Process for the preparation of substituted pyridyl-alkyl ketones | BAYER AG (DE) | 1989-01-18 | — | — | EP | disclosed |