Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPA3 | P15088 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | FOLH1 | Q04609 | 7/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.39 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5695683 | 0.84 | SLC6A3 (0.47) | TSHRALDH1A1CYP1A2GPR139 | |
| SCHEMBL5695679 | 0.84 | SLC6A3 (0.47) | TSHRALDH1A1CYP1A2GPR139 | |
| SCHEMBL6576344 | 0.83 | CYP1A2 (0.44) | CPA3TSHRCYP1A2 | |
| SCHEMBL6576342 | 0.83 | CYP1A2 (0.44) | CPA3TSHRCYP1A2 | |
| SCHEMBL5695682 | 0.80 | TSHR (0.46) | TSHRALDH1A1CYP1A2GPR139 | |
| SCHEMBL5695680 | 0.80 | TSHR (0.46) | TSHRALDH1A1CYP1A2GPR139 | |
| SCHEMBL6169492 | 0.79 | CYP1A2 (0.61) | CPA3CYP1A2FOLH1NAALAD2 | |
| SCHEMBL10647041 | 0.79 | TSHR (0.68) | TSHRALDH1A1GPR139 | |
| SCHEMBL6209557 | 0.79 | CYP1A2 (0.61) | CPA3CYP1A2FOLH1NAALAD2 | |
| SCHEMBL6162834 | 0.77 | GPR139 (0.46) | TSHRALDH1A1CYP1A2GPR139 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4927966-A | ANTITUMOR | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1990-05-22 | — | — | US | claimed |
| US-5010103-A | Anticarcinogenic agents | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF N.Y. (US) | 1991-04-23 | — | — | US | disclosed |
| US-4927966-A | ANTITUMOR | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1990-05-22 | — | — | US | disclosed |