Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | CD44 | P16070 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10799481 | 0.84 | CYP3A4 (0.45) | CYP3A4TSHRTDP1ALDH1A1TAAR1 | |
| SCHEMBL9800610 | 0.83 | CYP3A4 (0.64) | CYP3A4TSHRPIK3CATDP1ALDH1A1 | |
| SCHEMBL10510941 | 0.82 | TDP1 (0.48) | CYP3A4TDP1ALDH1A1SLC6A2SLC6A4 | |
| SCHEMBL10422322 | 0.81 | CYP3A4 (0.50) | CYP3A4TSHRPIK3CATDP1ALDH1A1 | |
| SCHEMBL12323449 | 0.81 | PKM (0.46) | CYP3A4TDP1ALDH1A1KDM4EHPGD | |
| SCHEMBL11658684 | 0.79 | POLB (0.44) | CYP3A4TSHRTDP1ALDH1A1TAAR1 | |
| SCHEMBL10799437 | 0.79 | SKP2 (0.49) | CYP3A4TSHRTDP1ALDH1A1SLC6A2 | |
| SCHEMBL10805311 | 0.79 | POLB (0.39) | CYP3A4TDP1ALDH1A1SLC6A2SLC6A4 | |
| SCHEMBL6206260 | 0.78 | CYP3A4 (0.52) | CYP3A4TSHRTDP1ALDH1A1SLC6A2 | |
| SCHEMBL9493658 | 0.78 | CALM1 (0.55) | CYP3A4TSHRPIK3CAALDH1A1HPGD |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0027953-B2 | PROCESS FOR PREPARING N,O-DISUBSTITUTED URETHANES | BAYER AG (DE) | 1986-11-05 | — | — | EP | disclosed |
| US-4430505-A | UREA, PRIMARY AMINES, ALCOHOLS | BAYER AKTIENGESELLSCHAFT (DE) | 1984-02-07 | — | — | US | disclosed |
| EP-0027940-B1 | PROCESS FOR PREPARING URETHANES | BAYER AG (DE) | 1983-09-14 | — | — | EP | disclosed |
| US-4388238-A | FROM PRIMARY AMINES, ALCOHOLS, AND CARBONYL COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1983-06-14 | — | — | US | disclosed |
| EP-0027952-B1 | PROCESS FOR PREPARING N,O-DISUBSTITUTED URETHANES | BAYER AG (DE) | 1983-04-13 | — | — | EP | disclosed |
| EP-0027953-B1 | PROCESS FOR PREPARING N,O-DISUBSTITUTED URETHANES | BAYER AG (DE) | 1983-02-16 | — | — | EP | disclosed |
| EP-0059400-A2 | Process for the preparation of urethanes | BAYER AG (DE) | 1982-09-08 | — | — | EP | disclosed |
| EP-0027952-A1 | Process for preparing N,O-disubstituted urethanes | BAYER AG (DE) | 1981-05-06 | — | — | EP | disclosed |
| EP-0027940-A1 | Process for preparing urethanes | BAYER AG (DE) | 1981-05-06 | — | — | EP | disclosed |
| EP-0027953-A1 | Process for preparing N,O-disubstituted urethanes | BAYER AG (DE) | 1981-05-06 | — | — | EP | disclosed |