Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL27637708 | 0.81 | POLB (0.37) | CYP1A2POLBALDH1A1TSHRLMNA | |
| SCHEMBL28777690 | 0.79 | CYP1A2 (0.37) | CYP1A2OPRL1ALDH1A1TSHRLMNA | |
| SCHEMBL8200036 | 0.79 | ALDH1A1 (0.55) | CYP1A2POLBOPRL1ALDH1A1TSHR | |
| SCHEMBL26255 | 0.79 | ALDH1A1 (0.55) | CYP1A2POLBOPRL1ALDH1A1TSHR | |
| SCHEMBL1764007 | 0.76 | CYP1A2 (0.36) | CYP1A2POLBALDH1A1TSHRLMNA | |
| SCHEMBL4115624 | 0.75 | — | — | |
| SCHEMBL5440202 | 0.73 | ALDH1A1 (0.47) | CYP1A2POLBALDH1A1TSHRLMNA | |
| SCHEMBL5440200 | 0.73 | ALDH1A1 (0.47) | CYP1A2POLBALDH1A1TSHRLMNA | |
| SCHEMBL5441678 | 0.73 | ALDH1A1 (0.47) | CYP1A2POLBALDH1A1TSHRLMNA | |
| SCHEMBL5437232 | 0.73 | ALDH1A1 (0.47) | CYP1A2POLBALDH1A1TSHRLMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-1626069-A | Branched chain amino acid-dependent aminotransferase inhibitors and their use in the treatment of diabetic retinopathy | WARNER LAMBERT CO (US) | 2005-06-15 | — | — | CN | claimed |
| CN-1626069-A | Branched chain amino acid-dependent aminotransferase inhibitors and their use in the treatment of diabetic retinopathy | WARNER LAMBERT CO (US) | 2005-06-15 | — | — | CN | disclosed |