Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MMEL1 | Q495T6 | 1/20 | 0.37 |
| ▸ | TLK2 | Q86UE8 | 2/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.35 |
| ▸ | GABRE | P78334 | 1/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9768122 | 0.76 | MMEL1 (0.38) | ALDH1A1MMEL1MME | |
| SCHEMBL4649294 | 0.74 | P4HA1 (0.43) | ALDH1A1HPGDSMN1; SMN2MMEL1GABRA1 | |
| SCHEMBL20992124 | 0.73 | HSD17B3 (0.46) | HSD17B3ALDH1A1HPGDSMN1; SMN2L3MBTL1 | |
| SCHEMBL16891423 | 0.71 | HSD17B3 (0.53) | HSD17B3ALDH1A1HPGDSMN1; SMN2L3MBTL1 | |
| SCHEMBL27386679 | 0.68 | HSD17B3 (0.53) | HSD17B3HPGDSMN1; SMN2L3MBTL1STS | |
| SCHEMBL9742618 | 0.68 | MMEL1 (0.36) | MMEL1MME | |
| SCHEMBL11899972 | 0.67 | NAPRT (0.56) | HSD17B3ALDH1A1HPGDSMN1; SMN2L3MBTL1 | |
| SCHEMBL568662 | 0.67 | HSD17B3 (0.52) | HSD17B3HPGDSMN1; SMN2L3MBTL1STS | |
| SCHEMBL29190968 | 0.67 | TDP1 (0.63) | HSD17B3ALDH1A1HPGDSMN1; SMN2L3MBTL1 | |
| SCHEMBL13838594 | 0.67 | SMN1; SMN2 (0.56) | HSD17B3HPGDSMN1; SMN2L3MBTL1GABRA1 |
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-3321261-B1 | HEDGEHOG ANTAGONISTS HAVING ZINC BINDING MOIETIES | CURIS INC (US) | 2020-06-17 | — | — | EP | disclosed |
| EP-3321261-A1 | HEDGEHOG ANTAGONISTS HAVING ZINC BINDING MOIETIES | Curis, Inc. (US) | 2018-05-16 | — | — | EP | disclosed |