Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.46 |
| ▸ | RXRA | P19793 | 2/20 | 0.35 |
| ▸ | RXRB | P28702 | 2/20 | 0.35 |
| ▸ | RXRG | P48443 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6818210 | 0.85 | LMNA (0.39) | ALDH1A1CYP1A2SMN1; SMN2USP2LMNA | |
| SCHEMBL7615860 | 0.84 | KMT2A (0.35) | ALDH1A1CYP1A2SMN1; SMN2USP2LMNA | |
| SCHEMBL6818265 | 0.79 | ALDH1A1 (0.46) | ALDH1A1CYP1A2SMN1; SMN2USP2LMNA | |
| SCHEMBL6821612 | 0.79 | ALDH1A1 (0.46) | ALDH1A1CYP1A2SMN1; SMN2USP2LMNA | |
| SCHEMBL6813342 | 0.79 | ALDH1A1 (0.46) | ALDH1A1CYP1A2SMN1; SMN2USP2LMNA | |
| SCHEMBL6818053 | 0.79 | ALDH1A1 (0.42) | ALDH1A1CYP1A2SMN1; SMN2USP2LMNA | |
| SCHEMBL6817658 | 0.79 | ALDH1A1 (0.42) | ALDH1A1CYP1A2SMN1; SMN2USP2LMNA | |
| SCHEMBL6817438 | 0.76 | ALDH1A1 (0.42) | ALDH1A1CYP1A2SMN1; SMN2USP2LMNA | |
| SCHEMBL6813653 | 0.76 | LMNA (0.42) | ALDH1A1CYP1A2SMN1; SMN2USP2LMNA | |
| SCHEMBL6818043 | 0.75 | ALDH1A1 (0.39) | ALDH1A1CYP1A2SMN1; SMN2USP2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1180094-B1 | FUSED POLYCYCLIC AMINO ACIDS AS PHARMACEUTICAL AGENTS | WARNER LAMBERT CO (US) | 2004-07-28 | — | — | EP | claimed |
| EP-1180094-B1 | FUSED POLYCYCLIC AMINO ACIDS AS PHARMACEUTICAL AGENTS | WARNER LAMBERT CO (US) | 2004-07-28 | — | — | EP | disclosed |