Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL7992980 | 1.00 | SERPINE1 (0.53) | SERPINE1ALDH1A1HPGDLMNACYP19A1 | |
| SCHEMBL8432260 | 1.00 | SERPINE1 (0.53) | SERPINE1ALDH1A1HPGDLMNACYP19A1 | |
| SCHEMBL8084785 | 0.83 | CYP19A1 (0.56) | SERPINE1ALDH1A1HPGDLMNACYP19A1 | |
| SCHEMBL12760812 | 0.83 | ALDH1A1 (0.46) | ALDH1A1HPGDLMNACYP19A1TRPM8 | |
| SCHEMBL8984221 | 0.83 | ALDH1A1 (0.58) | ALDH1A1HPGDLMNACYP19A1TRPM8 | |
| SCHEMBL9439650 | 0.81 | ALDH1A1 (0.47) | ALDH1A1HPGDLMNACYP19A1TRPM8 | |
| Phosphine SCHEMBL27943782 | 0.81 | ALDH1A1 (0.57) | ALDH1A1HPGDLMNACYP19A1TRPM8 | |
| SCHEMBL19897051 | 0.81 | SCN9A (0.47) | SERPINE1ALDH1A1HPGDLMNACYP19A1 | |
| SCHEMBL10775380 | 0.80 | ALDH1A1 (0.49) | ALDH1A1HPGDLMNACYP19A1TRPM8 | |
| SCHEMBL10771885 | 0.78 | ALDH1A1 (0.45) | SERPINE1ALDH1A1HPGDLMNACYP19A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6008401-A | CONDENSATION REACTION BETWEEN 4-HALO OR NITRO SUBSTITUTED BENZONITRILE DERIVATIVE AND OTICALLY ACTIVE ALCOHOL PRODUCES AN OPTICALLY ACTIVE ALKOXYBENZONITRILE DERIVATIVE | NIPPON OIL CO., LTD. (JP) | 1999-12-28 | — | — | US | disclosed |