Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.70 |
| ▸ | TSHR | P16473 | 1/20 | 0.70 |
| ▸ | KIF11 | P52732 | 2/20 | 0.58 |
| ▸ | TRPV6 | Q9H1D0 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | AHR | P35869 | 1/20 | 0.46 |
| ▸ | ACP3 | P15309 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.44 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.44 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9050608 | 0.87 | CYP19A1 (0.54) | CYP19A1ALDH1A1TSHRCYP3A4CYP2D6 | |
| SCHEMBL30915210 | 0.85 | ALDH1A1 (0.70) | CYP19A1ALDH1A1TSHRKIF11TRPV6 | |
| SCHEMBL7766770 | 0.85 | ALDH1A1 (0.70) | CYP19A1ALDH1A1TSHRKIF11TRPV6 | |
| SCHEMBL12264155 | 0.84 | CYP19A1 (0.55) | CYP19A1ALDH1A1TSHRKIF11CYP3A4 | |
| Triphenylmethanol SCHEMBL1332873 | 0.84 | CYP19A1 (0.50) | CYP19A1ALDH1A1TSHRCYP3A4CYP2D6 | |
| Trifluoromethylbenzene SCHEMBL27760126 | 0.84 | TSHR (1.00) | CYP19A1ALDH1A1TSHRKIF11TRPV6 | |
| Trifluoromethylbenzene SCHEMBL175647 | 0.84 | TSHR (1.00) | CYP19A1ALDH1A1TSHRKIF11TRPV6 | |
| Triphenylmethanol SCHEMBL700 | 0.84 | CYP19A1 (0.50) | CYP19A1ALDH1A1TSHRCYP3A4CYP2D6 | |
| Triphenylmethanol SCHEMBL456603 | 0.84 | CYP19A1 (0.50) | CYP19A1ALDH1A1TSHRCYP3A4CYP2D6 | |
| Trifluoromethylbenzene SCHEMBL8692 | 0.84 | TSHR (1.00) | CYP19A1ALDH1A1TSHRKIF11TRPV6 |
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 6 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-7531573-B2 | potent, selective and safe inhibitors of the Ca2+-activated potassium channel | CHILDREN'S MEDICAL CENTER CORPORATION (US) | 2009-05-12 | — | — | US | disclosed |
| US-7531573-B2 | potent, selective and safe inhibitors of the Ca2+-activated potassium channel | CHILDREN'S MEDICAL CENTER CORPORATION (US) | 2009-05-12 | — | — | 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 |