Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16740667 | 0.83 | TGM2 (0.45) | TSHRMAOBALDH1A1CYP2C19CYP1A2 | |
| SCHEMBL1067933 | 0.81 | TSHR (0.50) | TSHRMAOBMAOAALDH1A1CYP2D6 | |
| SCHEMBL27471576 | 0.78 | TSHR (0.57) | TSHRMAOBMAOAALDH1A1CYP2D6 | |
| SCHEMBL679046 | 0.78 | TSHR (0.61) | TSHRMAOBMAOAALDH1A1CYP2D6 | |
| SCHEMBL11092024 | 0.76 | CYP3A4 (0.58) | ALDH1A1CYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL9163048 | 0.76 | TSHR (0.54) | TSHRMAOBMAOAALDH1A1CYP2D6 | |
| SCHEMBL27911526 | 0.75 | ALDH1A1 (0.52) | TSHRMAOBMAOAALDH1A1CYP2D6 | |
| SCHEMBL22165229 | 0.74 | TSHR (0.53) | TSHRMAOBMAOAALDH1A1CYP2D6 | |
| SCHEMBL3136867 | 0.74 | THRB (0.55) | ALDH1A1CYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL18970231 | 0.74 | TSHR (0.56) | TSHRMAOBMAOAALDH1A1CYP2D6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015075051-A1 | ALLOSTERIC INHIBITORS OF ATYPICAL PROTEIN KINASES C | UNIVERSITAET DES SAARLANDES (DE) | 2015-05-28 | — | — | WO | disclosed |