Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 2/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL5384033 | 0.95 | LMNA (0.49) | SMN1; SMN2MAPTHPGDNPC1CYP1A2 | |
| SCHEMBL1929880 | 0.81 | LTA4H (0.57) | SMN1; SMN2MAPTHPGDNPC1CYP1A2 | |
| SCHEMBL5469381 | 0.81 | HTR2C (0.52) | SMN1; SMN2MAPTHPGDNPC1CYP1A2 | |
| SCHEMBL4192478 | 0.81 | LTA4H (0.56) | SMN1; SMN2MAPTHPGDNPC1CYP1A2 | |
| SCHEMBL5476571 | 0.81 | LTA4H (0.56) | SMN1; SMN2MAPTHPGDNPC1CYP1A2 | |
| SCHEMBL6203417 | 0.80 | GAA (0.42) | MAPTHTTCYP19A1 | |
| SCHEMBL5381777 | 0.79 | LTA4H (0.54) | SMN1; SMN2MAPTHPGDNPC1CYP1A2 | |
| SCHEMBL20304007 | 0.78 | SMN1; SMN2 (0.48) | SMN1; SMN2MAPTHPGDNPC1CYP1A2 | |
| SCHEMBL18788160 | 0.78 | HRH3 (0.56) | SMN1; SMN2MAPTHPGDNPC1CYP1A2 | |
| SCHEMBL5463028 | 0.78 | MAPT (0.47) | SMN1; SMN2MAPTHPGDNPC1CYP1A2 |
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-1100495-A4 | PROPENAMIDES AS CCR5 MODULATORS | SMITHKLINE BEECHAM CORP (US) | 2002-09-25 | — | — | EP | disclosed |
| EP-1100495-A1 | PROPENAMIDES AS CCR5 MODULATORS | SMITHKLINE BEECHAM CORPORATION (US) | 2001-05-23 | — | — | EP | disclosed |
| WO-2000006153-A1 | PROPENAMIDES AS CCR5 MODULATORS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-02-10 | — | — | WO | disclosed |