Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 10/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7314606 | 0.80 | ALDH1A1 (0.52) | ALDH1A1TDP1TSHRCYP3A4HSD17B10 | |
| SCHEMBL4427648 | 0.78 | ALDH1A1 (0.71) | ALDH1A1TDP1TSHRCYP3A4HSD17B10 | |
| SCHEMBL6645181 | 0.77 | TSHR (0.48) | ALDH1A1TDP1TSHRCYP3A4HSD17B10 | |
| SCHEMBL27801684 | 0.77 | ALDH1A1 (0.48) | ALDH1A1TDP1TSHRCYP3A4HSD17B10 | |
| SCHEMBL5205707 | 0.77 | ALDH1A1 (0.48) | ALDH1A1TDP1TSHRCYP3A4HSD17B10 | |
| SCHEMBL3635779 | 0.76 | KAT2B (0.50) | ALDH1A1TDP1TSHRCYP3A4KAT2B | |
| Butane SCHEMBL27499178 | 0.74 | ALDH1A1 (0.60) | ALDH1A1TDP1TSHRCYP3A4HSD17B10 | |
| SCHEMBL10749672 | 0.73 | ALDH1A1 (0.39) | ALDH1A1TDP1TSHRHPGDPOLB | |
| SCHEMBL66829 | 0.73 | ALDH1A1 (0.64) | ALDH1A1TDP1TSHRCYP3A4HSD17B10 | |
| SCHEMBL10761199 | 0.73 | TSHR (0.48) | ALDH1A1TDP1TSHRCYP3A4HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-RE31617-E | ANTICOAGULANTS; HYPOTENSIVE AND BRONCHODILATOR AGENTS | BRISTOL-MYERS COMPANY (US) | 1984-06-26 | — | — | US | disclosed |
| US-3932407-A | BRONCHODILATORS, HYPOTENSIVE AGENTS, ANTICOAGULANTS | BRISTOL-MYERS COMPANY (US) | 1976-01-13 | — | — | US | disclosed |