Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CPA1 | P15085 | 9/20 | 0.50 |
| ▸ | CPA3 | P15088 | 3/20 | 0.50 |
| ▸ | CPB1 | P15086 | 1/20 | 0.50 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.50 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.46 |
| ▸ | MME | P08473 | 1/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.42 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7540835 | 0.84 | CPA1 (0.72) | CYP1A2CPA1CPA3CPB1CPB2 | |
| SCHEMBL6154517 | 0.81 | CYP1A2 (0.55) | CYP1A2CPA1CPA3CPB1CPB2 | |
| SCHEMBL21758201 | 0.81 | CYP1A2 (0.55) | CYP1A2CPA1CPA3CPB1CPB2 | |
| SCHEMBL6154524 | 0.81 | CYP1A2 (0.55) | CYP1A2CPA1CPA3CPB1CPB2 | |
| SCHEMBL6155724 | 0.81 | CYP1A2 (0.55) | CYP1A2CPA1CPA3CPB1CPB2 | |
| SCHEMBL11239071 | 0.80 | TSHR (0.59) | CYP1A2CPA1CPA3CPB1CPB2 | |
| SCHEMBL11262596 | 0.80 | TSHR (0.59) | CYP1A2CPA1CPA3CPB1CPB2 | |
| SCHEMBL11129057 | 0.80 | TSHR (0.59) | CYP1A2CPA1CPA3CPB1CPB2 | |
| SCHEMBL8925188 | 0.79 | CYP1A2 (0.52) | CYP1A2CPA1CPA3CPB1CPB2 | |
| SCHEMBL27878857 | 0.79 | CYP1A2 (0.57) | CYP1A2CPA1CPA3CPB1CPB2 |
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-1207909-A2 | METHOD FOR COUPLING MOLECULES | MEDICAL RESEARCH COUNCIL (GB) | 2002-05-29 | — | — | EP | disclosed |
| WO-2001015737-A2 | METHOD FOR COUPLING MOLECULES | MEDICAL RESEARCH COUNCIL (GB) | 2001-03-08 | — | — | WO | disclosed |