Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | RXRA | P19793 | 1/20 | 0.30 |
| ▸ | RXRB | P28702 | 1/20 | 0.30 |
| ▸ | RXRG | P48443 | 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 | |
|---|---|---|---|---|
| SCHEMBL7611058 | 0.84 | KMT2A (0.35) | ALDH1A1CYP1A2TSHRUSP2LMNA | |
| SCHEMBL6817608 | 0.84 | ALDH1A1 (0.41) | ALDH1A1CYP1A2TSHRUSP2LMNA | |
| SCHEMBL6813502 | 0.83 | USP2 (0.46) | ALDH1A1CYP1A2TSHRUSP2LMNA | |
| SCHEMBL6818122 | 0.83 | ALDH1A1 (0.46) | ALDH1A1CYP1A2TSHRUSP2LMNA | |
| SCHEMBL6817239 | 0.82 | ALDH1A1 (0.42) | ALDH1A1CYP1A2TSHRUSP2LMNA | |
| SCHEMBL6818069 | 0.80 | ALDH1A1 (0.44) | ALDH1A1CYP1A2TSHRUSP2LMNA | |
| SCHEMBL6818099 | 0.79 | ALDH1A1 (0.46) | ALDH1A1CYP1A2TSHRUSP2LMNA | |
| SCHEMBL6822654 | 0.79 | ALDH1A1 (0.42) | ALDH1A1CYP1A2TSHRUSP2LMNA | |
| SCHEMBL6817487 | 0.79 | USP2 (0.42) | ALDH1A1CYP1A2TSHRUSP2LMNA | |
| SCHEMBL6817338 | 0.79 | USP2 (0.42) | ALDH1A1CYP1A2TSHRUSP2LMNA |
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 |