Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30274610 | 0.93 | ACHE (0.46) | ACHENFE2L2CYP3A4TDP1CES2 | |
| SCHEMBL1452106 | 0.93 | ACHE (0.46) | ACHENFE2L2CYP3A4TDP1CES2 | |
| Hydrochloric Acid SCHEMBL19712088 | 0.88 | ACHE (0.42) | ACHENFE2L2CYP3A4TDP1CES2 | |
| SCHEMBL7574245 | 0.86 | CYP3A4 (0.57) | ACHENFE2L2CYP3A4TDP1CES2 | |
| SCHEMBL19712090 | 0.84 | ACHE (0.39) | ACHENFE2L2CYP3A4TDP1CES2 | |
| SCHEMBL28382949 | 0.84 | ACHE (0.39) | ACHENFE2L2CYP3A4TDP1CES2 | |
| SCHEMBL1506225 | 0.82 | CA12 (0.42) | CYP3A4TDP1CES2CES1IDO1 | |
| SCHEMBL8638150 | 0.79 | CA12 (0.40) | CES2CES1IDO1 | |
| SCHEMBL10551850 | 0.79 | PSEN1 (0.38) | ACHENFE2L2CYP3A4TDP1PKM | |
| SCHEMBL13329 | 0.76 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5789624-A | HYDROFORMYLATION OF ALKENES TO ALDEHYDES USING A RHODIUM COMPLEX CATALYST | HOECHST CELANESE CORPORATION (US) | 1998-08-04 | — | — | US | claimed |
| US-5710338-A | FLUOROPHENYLPHOSPHINE LIGANDS FOR CATALYSTS | HOECHST CELANESE CORPORATION (US) | 1998-01-20 | — | — | US | claimed |
| US-5789624-A | HYDROFORMYLATION OF ALKENES TO ALDEHYDES USING A RHODIUM COMPLEX CATALYST | HOECHST CELANESE CORPORATION (US) | 1998-08-04 | — | — | US | disclosed |
| US-5773661-A | REACTION OF ALKALI METAL PHOSPHIDE WITH DISULFONIC ACID ESTEROF TRANS-2,3-NOBORNANEDIMETHANOL | CELANESE INTERNATIONAL CORPORATION (US) | 1998-06-30 | — | — | US | disclosed |
| US-5710337-A | RHODIUM COMPLEX OF BIS PHOSPHINE | HOECHST CELANESE CORPORATION (US) | 1998-01-20 | — | — | US | disclosed |
| US-5710338-A | FLUOROPHENYLPHOSPHINE LIGANDS FOR CATALYSTS | HOECHST CELANESE CORPORATION (US) | 1998-01-20 | — | — | US | disclosed |