Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1A | P07327 | 4/20 | 0.43 |
| ▸ | ADH1C | P00326 | 3/20 | 0.43 |
| ▸ | ADH4 | P08319 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | NAAA | Q02083 | 2/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9193281 | 1.00 | ADH1A (0.43) | ADH1AADH1CADH4CYP1A2DNM1 | |
| SCHEMBL16949691 | 1.00 | ADH1A (0.43) | ADH1AADH1CADH4CYP1A2DNM1 | |
| SCHEMBL3952910 | 0.98 | ADH1A (0.41) | ADH1AADH1CADH4CYP1A2DNM1 | |
| SCHEMBL2347728 | 0.92 | ADH1A (0.42) | ADH1AADH1CADH4CYP1A2THRA | |
| SCHEMBL460664 | 0.83 | ADH1A (0.50) | ADH1AADH1CCYP1A2ROCK2ROCK1 | |
| SCHEMBL16949669 | 0.81 | ADH1A (0.48) | ADH1AADH1CCYP1A2ROCK2ROCK1 | |
| SCHEMBL25399165 | 0.79 | THRA (0.49) | ADH1AADH1CADH4CYP1A2DNM1 | |
| SCHEMBL39006 | 0.79 | THRA (0.49) | ADH1AADH1CADH4CYP1A2DNM1 | |
| SCHEMBL39346 | 0.79 | THRA (0.49) | ADH1AADH1CADH4CYP1A2DNM1 | |
| SCHEMBL10893408 | 0.79 | ADH1A (0.46) | ADH1AADH1CADH4CYP1A2DNM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1265844-A1 | METHOD FOR PRODUCING AMINES BY THE HYDROAMINOMETHYLATION OF OLEFINS IN THE PRESENCE OF IONIC LIQUIDS | Bayer Aktiengesellschaft (DE) | 2002-12-18 | — | — | EP | disclosed |
| WO-2001064621-A1 | METHOD FOR PRODUCING AMINES BY THE HYDROAMINOMETHYLATION OF OLEFINS IN THE PRESENCE OF IONIC LIQUIDS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-09-07 | — | — | WO | disclosed |