Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | ANPEP | P15144 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3400591 | 0.90 | ALDH1A1 (0.61) | ALDH1A1KDM4ECYP3A4TSHRMAOA | |
| Hydrochloric Acid SCHEMBL11143978 | 0.89 | MAOA (0.46) | ALDH1A1KDM4EMAOAMEN1KMT2A | |
| SCHEMBL7603827 | 0.85 | ALDH1A1 (0.56) | ALDH1A1KDM4ECYP3A4TSHRMAOA | |
| SCHEMBL23665707 | 0.84 | ALDH1A1 (0.55) | ALDH1A1KDM4ECYP3A4TSHRMAOA | |
| SCHEMBL14397619 | 0.83 | ALDH1A1 (0.44) | ALDH1A1KDM4EMAOAMEN1KMT2A | |
| SCHEMBL9415969 | 0.83 | KDM4E (0.45) | ALDH1A1KDM4EMAOACNR2CHRM2 | |
| SCHEMBL14397621 | 0.81 | LMNA (0.49) | ALDH1A1KDM4EMAOACNR2CHRM2 | |
| SCHEMBL4917701 | 0.81 | ALDH1A1 (0.56) | ALDH1A1KDM4ECYP3A4TSHRMAOA | |
| SCHEMBL7586932 | 0.81 | ALDH1A1 (0.45) | ALDH1A1KDM4EMAOAMEN1KMT2A | |
| SCHEMBL19401274 | 0.81 | PPARG (0.45) | ALDH1A1KDM4EMEN1KMT2ACNR2 |
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 |