Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.40 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9517400 | 0.85 | HTR3A (0.48) | HTR3ASLC6A2SLC6A3LMNACYP2A6 | |
| SCHEMBL9517403 | 0.85 | HTR3A (0.48) | HTR3ASLC6A2SLC6A3LMNACYP2A6 | |
| SCHEMBL315186 | 0.80 | HTR3A (0.58) | HTR3ASLC6A2SLC6A3LMNACYP2A6 | |
| SCHEMBL694010 | 0.77 | HTR3A (0.50) | HTR3ASLC6A2SLC6A3LMNACYP2A6 | |
| SCHEMBL4038924 | 0.76 | KDM1A (0.44) | SLC6A2SLC6A3DRD2MAP1LC3BHTR2A | |
| SCHEMBL218475 | 0.76 | HTR3A (0.59) | HTR3ASLC6A2SLC6A3LMNACYP2A6 | |
| SCHEMBL9517943 | 0.76 | ACHE (0.42) | LMNAALDH1A1POLBALOX12HTT | |
| SCHEMBL435619 | 0.76 | HTR3A (0.59) | HTR3ASLC6A2SLC6A3LMNACYP2A6 | |
| SCHEMBL2013478 | 0.74 | SLC18A3 (0.48) | SLC6A2SLC6A3LMNACYP2A6HSD17B10 | |
| SCHEMBL655216 | 0.74 | HTR3A (0.43) | HTR3ASLC6A2SLC6A3LMNAALDH1A1 |
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-2012044567-A2 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |