Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.30 |
| ▸ | CPT2 | P23786 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3499694 | 0.81 | HMGCR (0.36) | HMGCRCHRM1TBXA2RADRA1ACYP2D6 | |
| SCHEMBL7808998 | 0.77 | ALDH1A1 (0.38) | TSHRTDP1ALDH1A1 | |
| SCHEMBL19546062 | 0.77 | ALDH1A1 (0.38) | TSHRTDP1ALDH1A1 | |
| SCHEMBL28761111 | 0.73 | KDM4E (0.50) | HMGCRCHRM1TBXA2RADRA1ACYP2D6 | |
| SCHEMBL1548240 | 0.72 | ALDH1A1 (0.47) | HMGCRCHRM1TBXA2RADRA1ACYP2D6 | |
| SCHEMBL1670466 | 0.71 | HMGCR (0.39) | HMGCRCHRM1TBXA2RADRA1ACYP2D6 | |
| SCHEMBL19546009 | 0.70 | ALDH1A1 (0.33) | TSHRTDP1ALDH1A1 | |
| SCHEMBL27649374 | 0.70 | HMGCR (0.42) | HMGCRCHRM1TBXA2RADRA1ACYP2D6 | |
| SCHEMBL13121096 | 0.70 | GAA (0.37) | ALDH1A1 | |
| SCHEMBL25946689 | 0.69 | HMGCR (0.33) | HMGCRCHRM1TBXA2RADRA1ACYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5340802-A | Central nervous system disorders | ABBOTT LABORATORIES (US) | 1994-08-23 | — | — | US | disclosed |
| EP-0405506-A1 | Tetrapeptide type-B CCK receptor ligands | ABBOTT LABORATORIES (US) | 1991-01-02 | — | — | EP | disclosed |