Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | PRKCA | P17252 | 6/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7826806 | 0.95 | PRKCA (0.42) | CYP1A2CYP2C9CYP2C19PRKCAMCHR1 | |
| SCHEMBL7830779 | 0.95 | PRKCA (0.42) | CYP1A2CYP2C9CYP2C19PRKCAMCHR1 | |
| SCHEMBL7827488 | 0.93 | MCHR1 (0.35) | CYP1A2CYP2C9CYP2C19PRKCAMCHR1 | |
| SCHEMBL7822891 | 0.89 | CYP1A2 (0.38) | CYP1A2CYP2C9CYP2C19PRKCAMCHR1 | |
| SCHEMBL7824104 | 0.88 | PDK2 (0.43) | TP53PDK2TSHR | |
| SCHEMBL7827899 | 0.84 | PRKCA (0.40) | CYP1A2CYP2C9CYP2C19PRKCAMCHR1 | |
| SCHEMBL7828606 | 0.84 | PRKCA (0.40) | CYP1A2CYP2C9CYP2C19PRKCAMCHR1 | |
| SCHEMBL7827247 | 0.82 | PDK2 (0.36) | CYP1A2CYP2C19PRKCAMCHR1PDK2 | |
| SCHEMBL7823190 | 0.81 | CYP1A2 (0.40) | CYP1A2CYP2C9CYP2C19MCHR1CYP19A1 | |
| SCHEMBL7825538 | 0.81 | PDK2 (0.39) | TP53PDK2ELANE |
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-0679640-B1 | Carboxylate and heat-sensitive recording material using same | MITSUI CHEMICALS INC (JP) | 2001-08-08 | — | — | EP | disclosed |
| US-5691272-A | Carboxylate and heat-sensitive recording material using same | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-11-25 | — | — | US | disclosed |
| US-5559247-A | Carboxylate and heat-sensitive recording material using same | MITSUI TOATSU CHEMICALS, INC. (JP) | 1996-09-24 | — | — | US | disclosed |
| EP-0679640-A1 | Carboxylate and heat-sensitive recording material using same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1995-11-02 | — | — | EP | disclosed |