Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.64 |
| ▸ | CA12 | O43570 | 2/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.49 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.46 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9571675 | 0.90 | ESR1 (0.58) | ESR1CA12ESR2CA2CA9 | |
| SCHEMBL9571688 | 0.89 | ESR1 (0.57) | ESR1CA12ESR2NR1H3CA2 | |
| SCHEMBL9453222 | 0.89 | ESR1 (0.56) | ESR1CA12ESR2CA2CA9 | |
| SCHEMBL9453259 | 0.87 | FAAH (0.58) | ESR1CA12ESR2NR1H3CA2 | |
| SCHEMBL9453288 | 0.82 | ESR1 (0.63) | ESR1CA12ESR2CA2CA9 | |
| SCHEMBL9566639 | 0.82 | NPC1 (0.63) | ESR1CA12ESR2CA2CA9 | |
| SCHEMBL9566635 | 0.82 | KMT2A (0.57) | ESR1CA12NR1H3CA2CA9 | |
| SCHEMBL9453234 | 0.82 | MGLL (0.51) | ESR1ESR2NR1H3SCN2AKMT2A | |
| SCHEMBL18589041 | 0.81 | ESR1 (0.68) | ESR1CA12CA7ESR2NR1H3 | |
| SCHEMBL9571706 | 0.81 | CASP1 (0.71) | ESR1CA12ESR2CA2CA9 |
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-5672750-A | Preparation of aromatic amides from carbon monoxide, an amine and an aromatic chloride | EASTMAN CHEMICAL COMPANY (US) | 1997-09-30 | — | — | US | disclosed |