Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.47 |
| ▸ | CTSS | P25774 | 1/20 | 0.47 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | LY96 | Q9Y6Y9 | 1/20 | 0.45 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.42 |
| ▸ | MIF | P14174 | 1/20 | 0.41 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.41 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MDM4 | O15151 | 1/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 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 | |
|---|---|---|---|---|
| SCHEMBL15697338 | 1.00 | ESR1 (0.47) | ESR1ESR2CTSSCTSKTAAR1 | |
| SCHEMBL12317087 | 0.85 | CYP3A4 (0.42) | SLC7A5ITGA4ITGB7 | |
| SCHEMBL21601599 | 0.85 | ITGA4 (0.51) | CTSSCTSKITGA4ITGB7TSHR | |
| SCHEMBL12029131 | 0.85 | ITGA4 (0.51) | CTSSCTSKITGA4ITGB7TSHR | |
| SCHEMBL13108100 | 0.85 | ITGA4 (0.51) | CTSSCTSKITGA4ITGB7TSHR | |
| SCHEMBL23582645 | 0.84 | KMT2A (0.45) | ITGA4ITGB7KMT2A | |
| SCHEMBL2723926 | 0.84 | LDHA (0.54) | ITGA4ITGB7 | |
| SCHEMBL13108101 | 0.84 | ACACB (0.51) | CTSK | |
| SCHEMBL4025857 | 0.83 | ESR1 (0.47) | ESR1ESR2CTSSCTSKTAAR1 | |
| SCHEMBL630703 | 0.82 | SLC7A5 (0.57) | ESR1ESR2CTSSCTSKTAAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1997045884-A9 | FLAME-RETARDANT BATTERY CASING | — | 1998-03-12 | — | — | WO | disclosed |
| EP-0595832-A1 | HIGH MODULUS TOUGHENED POLYAMIDE COMPOSITION. | EXXON CHEMICAL PATENTS INC (US) | 1994-05-11 | — | — | EP | disclosed |
| WO-1992021722-A1 | HIGH MODULUS TOUGHENED POLYAMIDE COMPOSITION | EXXON CHEMICAL PATENTS INC. (US) | 1992-12-10 | — | — | WO | disclosed |
| US-5047476-A | Mixing copolymer containing hydrolyzable grafted silicon group dihydrocarbyltin oxide, carboxylic acid, water, then heating | UNION CARBIDE CHEMICALS AND PLASTICS COMPANY INC. (US) | 1991-09-10 | — | — | US | disclosed |