Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.30 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | ACAT1 | P24752 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11683840 | 0.84 | — | — | |
| SCHEMBL5274921 | 0.84 | GABRA1 (0.46) | TSHRALDH1A1HIF1ACYP2C9CYP2C19 | |
| SCHEMBL8953819 | 0.84 | IDO1 (0.36) | ALDH1A1CYP2C9CYP3A4MAPT | |
| SCHEMBL727276 | 0.84 | ALDH1A1 (0.46) | TSHRALDH1A1 | |
| SCHEMBL10930855 | 0.80 | LMNA (0.46) | TSHRALDH1A1CYP2C9CYP2C19LMNA | |
| SCHEMBL21175615 | 0.80 | CA1 (0.46) | TSHRALDH1A1CYP2C19CYP3A4MAPK1 | |
| SCHEMBL11600460 | 0.80 | ALDH1A1 (0.50) | TSHRALDH1A1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL5830287 | 0.77 | ALDH1A1 (0.46) | TSHRALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL109223 | 0.76 | TSHR (0.50) | TSHRALDH1A1CYP2C19KDM4ELMNA | |
| Benzene SCHEMBL28136546 | 0.76 | TSHR (0.50) | TSHRALDH1A1CYP2C19KDM4ELMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5010161-A | Of poly (phenylenebisalkylene) poly (phenylamine) with aldehyde, regenerated under hydrolysis, for use in moisture curable polyurethanes | MITSUI TOATSU CHEMICALS, INC. (JP) | 1991-04-23 | — | — | US | disclosed |
| EP-0375318-A2 | Polyaldimine derivatives | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1990-06-27 | — | — | EP | disclosed |
| US-4005156-A | Novel flame retardant compositions of matter | UNIVERSAL OIL PRODUCTS COMPANY (US) | 1977-01-25 | — | — | US | disclosed |