Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 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 | |
|---|---|---|---|---|
| SCHEMBL230222 | 0.82 | CHRM2 (0.70) | CHRM2MAOAMAOBKDM4ESMN1; SMN2 | |
| SCHEMBL29438821 | 0.82 | CHRM2 (0.70) | CHRM2MAOAMAOBKDM4ESMN1; SMN2 | |
| SCHEMBL18493706 | 0.80 | CHRM2 (0.68) | CHRM2MAOAMAOBKDM4ESMN1; SMN2 | |
| Zinc Ion SCHEMBL30442739 | 0.80 | CHRM2 (0.68) | CHRM2MAOAMAOBKDM4ESMN1; SMN2 | |
| SCHEMBL317984 | 0.80 | CHRM2 (0.68) | CHRM2MAOAMAOBKDM4ESMN1; SMN2 | |
| SCHEMBL25211342 | 0.80 | CHRM2 (0.68) | CHRM2MAOAMAOBKDM4ESMN1; SMN2 | |
| Zinc Ion SCHEMBL30205248 | 0.80 | CHRM2 (0.68) | CHRM2MAOAMAOBKDM4ESMN1; SMN2 | |
| SCHEMBL668548 | 0.79 | L3MBTL1 (0.44) | MAOAMAOBSMN1; SMN2L3MBTL1ALDH1A1 | |
| SCHEMBL1492627 | 0.77 | HRH1 (0.50) | SMN1; SMN2ALDH1A1ALOX15 | |
| SCHEMBL3761928 | 0.76 | POLB (0.63) | KDM4ESMN1; SMN2L3MBTL1ALDH1A1ALOX15 |
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-6333336-B1 | GAMMA-AMINOBUTYRIC ACID RECEPTORS AS ANTICONVULSANTS FORMING THE COMPOUND BY AMIDATION | MERCK SHARP & DOHME LTD. (GB) | 2001-12-25 | — | — | US | disclosed |
| EP-1064283-A1 | PYRAZOLO-PYRIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LTD. (GB) | 2001-01-03 | — | — | EP | disclosed |
| WO-1999048892-A1 | PYRAZOLO-PYRIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LIMITED (GB) | 1999-09-30 | — | — | WO | disclosed |