Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL7902294 | 0.88 | GAA (0.39) | CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL8203452 | 0.85 | CYP1A2 (0.36) | CYP1A2CYP2D6CYP2C19KMT2AGPR84 | |
| SCHEMBL24779295 | 0.83 | TRPV1 (0.36) | SIGMAR1 | |
| SCHEMBL10323632 | 0.82 | ALDH1A1 (0.44) | CYP1A2GPR84CYP1B1 | |
| SCHEMBL29350037 | 0.82 | ALDH1A1 (0.44) | CYP1A2GPR84CYP1B1 | |
| SCHEMBL146878 | 0.82 | ALDH1A1 (0.44) | CYP1A2GPR84CYP1B1 | |
| SCHEMBL5107 | 0.82 | ALDH1A1 (0.44) | CYP1A2GPR84CYP1B1 | |
| SCHEMBL29496111 | 0.82 | ALDH1A1 (0.44) | CYP1A2GPR84CYP1B1 | |
| SCHEMBL729691 | 0.80 | ALDH1A1 (0.42) | CYP1A2GPR84CYP1B1 | |
| SCHEMBL3416712 | 0.80 | ALDH1A1 (0.42) | CYP1A2GPR84CYP1B1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6043398-A | WATER-SOLUBLE, SULFONATED DIPHOSPHINES COMPLEXED WITH A TRANSITION METAL TO FORM HYDROFORMYLATION CATALYSTS; OUTSTANDING SURFACE ACTIVE PROPERTIES IN TWO PHASE CATALYSIS OF TWO PHASE HYDROFORMYLATION OF OCT-1-ENE OLEFINS | CELANESE INTERNATIONAL CORPORATION (US) | 2000-03-28 | — | — | US | disclosed |
| US-5929273-A | METALLATION OF ARYLPHOSPHINE HALIDE BY HEATING AND PRESSURIZING IN SUITABLE CONDITIONS TO FORM ARYLPHSPHINIDE, COUPLING THE FORMED INTERMEDIATE WITH ORGANIC HALIDE TO FORM ARYL DIPHOSPHINE | CELANESE INTERNATIONAL CORP (US) | 1999-07-27 | — | — | US | disclosed |
| US-5777087-A | Aryl diphosphines and catalysts containing the same | CELANESE INTERNATIONAL CORPORATION (US) | 1998-07-07 | — | — | US | disclosed |