Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SYK | P43405 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 3/20 | 0.41 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NNMT | P40261 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SLC2A1 | P11166 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15738937 | 0.87 | AGBL2 (0.46) | AGBL2POLBPKMALDH1A1KDM4E | |
| SCHEMBL27855175 | 0.79 | CSF1R (0.51) | KMT2ASYKPARP1CSF1R | |
| SCHEMBL17467966 | 0.71 | CSF1R (0.39) | SYKCSF1RNNMT | |
| SCHEMBL15922616 | 0.70 | SMN1; SMN2 (0.53) | KMT2AAGBL2ALDH1A1KDM4EMAPT | |
| SCHEMBL16666657 | 0.70 | KMT2A (0.50) | KMT2ASYKPARP1AGBL2ALDH1A1 | |
| SCHEMBL1865699 | 0.70 | SMN1; SMN2 (0.53) | KMT2ASYKPARP1AGBL2ALDH1A1 | |
| SCHEMBL11159389 | 0.70 | PARP1 (0.54) | KMT2ASYKPARP1CSF1RALDH1A1 | |
| SCHEMBL15862919 | 0.69 | KMT2A (0.49) | KMT2ASYKPARP1AGBL2ALDH1A1 | |
| SCHEMBL30056948 | 0.69 | CASP1 (0.52) | KMT2AALDH1A1MAPTSMN1; SMN2GAA | |
| SCHEMBL2634210 | 0.69 | CASP1 (0.52) | KMT2AALDH1A1MAPTSMN1; SMN2GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-9248122-B2 | Heteroquinoline-3-carboxamides as KCNQ2/3 modulators | Grünenthal GmbH (DE) | 2016-02-02 | — | — | US | disclosed |