Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 8/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL6922739 | 0.92 | MAPK14 (0.45) | ALDH1A1MAPK1KDM4EMCHR1HTR2C | |
| SCHEMBL6827367 | 0.90 | MCHR1 (0.53) | ALDH1A1MAPTMAPK1LMNAKDM4E | |
| SCHEMBL6918913 | 0.89 | HTR1F (0.50) | ALDH1A1MAPTLMNAKDM4ESMN1; SMN2 | |
| SCHEMBL6824937 | 0.89 | MEN1 (0.46) | ALDH1A1MAPTMAPK1KDM4EMCHR1 | |
| SCHEMBL6829437 | 0.89 | ALDH1A1 (0.46) | ALDH1A1MAPTMAPK1USP2KDM4E | |
| SCHEMBL6918359 | 0.88 | MCHR1 (0.43) | ALDH1A1MAPTMAPK1LMNAKDM4E | |
| SCHEMBL6924507 | 0.88 | THRB (0.48) | ALDH1A1MAPTMAPK1LMNAMCL1 | |
| SCHEMBL6824617 | 0.85 | NPC1 (0.45) | ALDH1A1MAPTLMNAUSP2TP53 | |
| SCHEMBL6827280 | 0.85 | ABCB1 (0.46) | ALDH1A1MAPTLMNAKDM4ETP53 | |
| SCHEMBL6827434 | 0.85 | MAPT (0.53) | ALDH1A1MAPTMAPK1LMNATP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004010943-A2 | SUBSTITUTED BENZANILIDES AS MODULATORS OF THE CCR5 RECEPTOR | SMITHKLINE BEECHAM CORPORATION (US) | 2004-02-05 | — | — | WO | claimed |
| WO-2004010943-A2 | SUBSTITUTED BENZANILIDES AS MODULATORS OF THE CCR5 RECEPTOR | SMITHKLINE BEECHAM CORPORATION (US) | 2004-02-05 | — | — | WO | disclosed |