Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.47 |
| ▸ | CRHBP | P24387 | 1/20 | 0.46 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11591149 | 0.88 | CRHBP (0.53) | ALDH1A1TSHRCYP3A4CYP2D6CYP19A1 | |
| SCHEMBL7768876 | 0.82 | ALDH1A1 (0.50) | ALDH1A1TSHRCYP3A4CYP2D6CYP19A1 | |
| Trifluoromethylbenzene SCHEMBL28876860 | 0.78 | TSHR (0.74) | ALDH1A1TSHRCYP19A1PTPN1LMNA | |
| SCHEMBL2131459 | 0.77 | CYP3A4 (0.60) | ALDH1A1TSHRCYP3A4CYP2D6CYP19A1 | |
| SCHEMBL30114522 | 0.77 | CYP3A4 (0.60) | ALDH1A1TSHRCYP3A4CYP2D6CYP19A1 | |
| SCHEMBL2243767 | 0.77 | KCNN4 (0.53) | ALDH1A1TSHRCYP3A4CYP2D6CYP19A1 | |
| SCHEMBL63469 | 0.77 | ALDH1A1 (0.52) | ALDH1A1TSHRCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL29441997 | 0.77 | ALDH1A1 (0.52) | ALDH1A1TSHRCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL1758324 | 0.76 | CRHBP (0.48) | ALDH1A1TSHRCYP3A4CYP2D6CYP19A1 | |
| SCHEMBL12264154 | 0.76 | CYP19A1 (0.71) | ALDH1A1TSHRCYP3A4CYP2D6CYP19A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8026263-B2 | Methods for inhibiting neoproliferative changes in blood vessel walls | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2011-09-27 | — | — | US | disclosed |
| US-8026263-B2 | Methods for inhibiting neoproliferative changes in blood vessel walls | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2011-09-27 | — | — | US | disclosed |
| US-7235577-B1 | Non-peptide inhibition of T-lymphocyte activation and therapies related thereto | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2007-06-26 | — | — | US | disclosed |
| US-7235577-B1 | Non-peptide inhibition of T-lymphocyte activation and therapies related thereto | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2007-06-26 | — | — | US | disclosed |