Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.64 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | CNR1 | P21554 | 2/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL9864644 | 0.82 | TRPA1 (0.64) | TRPA1POLBALOX15ALOX12KDM4E | |
| SCHEMBL10411345 | 0.79 | NPC1 (0.55) | CNR1CNR2ALOX15KDM4EALDH1A1 | |
| SCHEMBL1425180 | 0.79 | KDM4E (0.41) | TRPA1BACE1ALOX15KDM4EALDH1A1 | |
| SCHEMBL20349304 | 0.79 | IDO1 (0.43) | TRPA1BACE1ALOX15KDM4EALDH1A1 | |
| SCHEMBL6348838 | 0.78 | TRPA1 (0.46) | TRPA1ALDH1A1MAPTCYP1A2CYP2A6 | |
| SCHEMBL56556 | 0.78 | TRPA1 (1.00) | TRPA1POLBCNR1BACE1ALOX15 | |
| SCHEMBL30290839 | 0.78 | TRPA1 (1.00) | TRPA1POLBCNR1BACE1ALOX15 | |
| SCHEMBL9644574 | 0.78 | KAT8 (0.57) | CNR1CNR2ALOX15KDM4EALDH1A1 | |
| SCHEMBL9845813 | 0.77 | KAT8 (0.59) | ALOX15KDM4EALDH1A1HSD17B10ESR1 | |
| SCHEMBL10945340 | 0.77 | KAT8 (0.59) | ALOX15KDM4EALDH1A1HSD17B10ESR1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4287372-A | Preparation of nitro-substituted diphenyl ethers | UOP INC. (US) | 1981-09-01 | — | — | US | disclosed |
| US-4042705-A | 1-Methyl-2-(phenyl-oxymethyl)-5-nitro-imidazoles and process for their manufacture | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-08-16 | — | — | US | disclosed |
| US-4027018-A | INSECTICIDES, ACARACIDES, NEMATOCIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1977-05-31 | — | — | US | disclosed |
| US-4000270-A | INSECTIDES, ACARICIDES, NEMATOCIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-12-28 | — | — | US | disclosed |
| US-3954919-A | INSECTICIDES, MITICIDES, NEMATOCIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-05-04 | — | — | US | disclosed |