Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 4/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5454194 | 0.85 | CYP3A4 (0.32) | CYP3A4TDP1GABRA1GABRB2 | |
| SCHEMBL27908650 | 0.85 | GABRA1 (0.54) | CYP3A4TDP1GABRA1GABRB2ESR1 | |
| SCHEMBL3963448 | 0.83 | CYP3A4 (0.41) | CYP3A4TDP1ESR1ESR2 | |
| SCHEMBL27504866 | 0.82 | ADRA2A (0.39) | CYP3A4TDP1ESR1TSHRSLC6A2 | |
| SCHEMBL7059781 | 0.82 | ALDH1A1 (0.47) | CYP1A2CYP2C9SLC6A4CYP2A6 | |
| SCHEMBL27925139 | 0.80 | DPP4 (0.37) | SLC6A2TAAR1MAOASLC6A4SLC6A3 | |
| SCHEMBL27991666 | 0.80 | CD44 (0.36) | CYP3A4TSHRSLC6A2TAAR1MAOA | |
| SCHEMBL7781865 | 0.80 | TAAR1 (0.39) | CYP3A4TDP1TSHRLMNAHIF1A | |
| SCHEMBL5107698 | 0.80 | TAAR1 (0.39) | CYP3A4TDP1TSHRLMNAHIF1A | |
| SCHEMBL2880133 | 0.79 | CYP3A4 (0.30) | CYP3A4TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0627439-B1 | Hydroformylation process using novel phosphine-rhodium catalyst system | EASTMAN CHEM CO (US) | 1999-07-21 | — | — | EP | disclosed |
| EP-0627439-A1 | Hydroformylation process using novel phosphine-rhodium catalyst system | EASTMAN CHEMICAL COMPANY (US) | 1994-12-07 | — | — | EP | disclosed |
| US-5344988-A | Hydroformylation process using novel phosphine-rhodium catalyst system | EASTMAN CHEMICAL COMPANY (US) | 1994-09-06 | — | — | US | disclosed |
| US-5332846-A | Hydroformylation process using novel phosphine-rhodium catalyst system | EASTMAN KODAK COMPANY (US) | 1994-07-26 | — | — | US | disclosed |