Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.70 |
| ▸ | TSHR | P16473 | 2/20 | 0.70 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.70 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.70 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.48 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL7851197 | 1.00 | CYP3A4 (0.70) | CYP3A4ALDH1A1TSHRTDP1MAPK1 | |
| SCHEMBL9486763 | 1.00 | CYP3A4 (0.70) | CYP3A4ALDH1A1TSHRTDP1MAPK1 | |
| 4,4'-Methylenedianiline SCHEMBL3358403 | 0.85 | CYP3A4 (0.70) | CYP3A4ALDH1A1TSHRTDP1MAPK1 | |
| SCHEMBL6362775 | 0.84 | CYP3A4 (1.00) | CYP3A4ALDH1A1TSHRTDP1CYP17A1 | |
| SCHEMBL1304762 | 0.84 | CYP3A4 (1.00) | CYP3A4ALDH1A1TSHRTDP1CYP17A1 | |
| SCHEMBL3482770 | 0.84 | CYP3A4 (1.00) | CYP3A4ALDH1A1TSHRTDP1CYP17A1 | |
| 4,4'-Methylenedianiline SCHEMBL15105282 | 0.84 | CYP3A4 (1.00) | CYP3A4ALDH1A1TSHRTDP1CYP17A1 | |
| SCHEMBL8094139 | 0.84 | CYP3A4 (1.00) | CYP3A4ALDH1A1TSHRTDP1CYP17A1 | |
| 4,4'-Methylenedianiline SCHEMBL28001 | 0.84 | CYP3A4 (1.00) | CYP3A4ALDH1A1TSHRTDP1CYP17A1 | |
| SCHEMBL9485438 | 0.84 | CYP3A4 (1.00) | CYP3A4ALDH1A1TSHRTDP1MAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5708152-A | DERIVATIVES AS HUMECTANTS AND ANTIDEPOSIT AGENTS | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1998-01-13 | — | — | US | disclosed |
| EP-0023406-B1 | PROCESS FOR PREPARING AROMATIC POLYIMIDE SEMIPERMEABLE MEMBRANES | UBE INDUSTRIES, LTD. (JP) | 1983-04-13 | — | — | EP | disclosed |