Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.40 |
| ▸ | BPTF | Q12830 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP4 | P49662 | 1/20 | 0.37 |
| ▸ | CASP5 | P51878 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | HTR1D | P28221 | 2/20 | 0.36 |
| ▸ | HTR7 | P34969 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2646178 | 0.90 | CYP1A2 (0.48) | CYP1A2MEN1GFERKMT2ATDP1 | |
| SCHEMBL30893809 | 0.90 | CYP1A2 (0.48) | CYP1A2MEN1GFERKMT2ATDP1 | |
| SCHEMBL2648429 | 0.88 | CYP1A2 (0.46) | CYP1A2MEN1GFERKMT2ASMN1; SMN2 | |
| SCHEMBL195203 | 0.86 | BPTF (0.51) | CYP1A2CHRNB2CHRNA4BPTFMEN1 | |
| SCHEMBL30282824 | 0.86 | BPTF (0.51) | CYP1A2CHRNB2CHRNA4BPTFMEN1 | |
| SCHEMBL2655169 | 0.75 | ALDH1A1 (0.40) | CYP1A2MEN1GFERKMT2ATDP1 | |
| SCHEMBL30378500 | 0.73 | MAPT (0.46) | CYP1A2KMT2ASMN1; SMN2TDP1KDM4E | |
| SCHEMBL18038817 | 0.73 | SMARCA2 (0.51) | CYP1A2MEN1KMT2ATDP1ALDH1A1 | |
| SCHEMBL2647859 | 0.73 | MAPT (0.46) | CYP1A2KMT2ASMN1; SMN2TDP1KDM4E | |
| SCHEMBL15687937 | 0.70 | SMARCA2 (0.50) | CYP1A2MEN1KMT2ATDP1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0915875-A2 | SUBSTITUTED TRIAZOLO-PYRIDAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LTD. (GB) | 1999-05-19 | — | — | EP | disclosed |
| WO-1998004559-A2 | SUBSTITUTED TRIAZOLO-PYRIDAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LIMITED (GB) | 1998-02-05 | — | — | WO | disclosed |