Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 9/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 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 | |
|---|---|---|---|---|
| SCHEMBL6827367 | 0.90 | MCHR1 (0.53) | MCHR1ALDH1A1SMN1; SMN2KDM4EGAA | |
| SCHEMBL6918913 | 0.90 | HTR1F (0.50) | ALDH1A1SMN1; SMN2KDM4EKMT2AMAPT | |
| SCHEMBL6829437 | 0.90 | ALDH1A1 (0.46) | MCHR1ALDH1A1SMN1; SMN2KDM4EGAA | |
| SCHEMBL6824937 | 0.90 | MEN1 (0.46) | MCHR1ALDH1A1SMN1; SMN2KDM4EGAA | |
| SCHEMBL6924507 | 0.89 | THRB (0.48) | MCHR1ALDH1A1SMN1; SMN2KDM4EGAA | |
| SCHEMBL6827434 | 0.88 | MAPT (0.53) | MCHR1ALDH1A1SMN1; SMN2GAAMAPK1 | |
| SCHEMBL6824487 | 0.88 | ALDH1A1 (0.46) | MCHR1ALDH1A1SMN1; SMN2KDM4EGAA | |
| SCHEMBL6824617 | 0.86 | NPC1 (0.45) | MCHR1ALDH1A1SMN1; SMN2KMT2ASLC5A7 | |
| SCHEMBL6827280 | 0.86 | ABCB1 (0.46) | MCHR1ALDH1A1SMN1; SMN2KDM4EKMT2A | |
| SCHEMBL6827377 | 0.86 | CYP1A2 (0.46) | MCHR1ALDH1A1SMN1; SMN2KDM4EGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004010943-A2 | SUBSTITUTED BENZANILIDES AS MODULATORS OF THE CCR5 RECEPTOR | SMITHKLINE BEECHAM CORPORATION (US) | 2004-02-05 | — | — | WO | disclosed |