Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 5/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL4940329 | 0.85 | NTRK1 (0.42) | POLBHTR6PTGS2 | |
| SCHEMBL15307034 | 0.84 | HTR6 (0.40) | POLBTDP1L3MBTL1HTR6MEN1 | |
| SCHEMBL23013548 | 0.75 | DHODH (0.41) | HTR6PTGS2LMNAKDM4EALDH1A1 | |
| SCHEMBL23047161 | 0.74 | PDE10A (0.44) | L3MBTL1HTR6MEN1KMT2APTGS2 | |
| SCHEMBL21033308 | 0.74 | HTR6 (0.41) | HTR6CYP2C9CYP2C19MEN1KMT2A | |
| SCHEMBL5570998 | 0.74 | DHODH (0.41) | POLBTDP1L3MBTL1CYP1A2CYP2C9 | |
| SCHEMBL3714513 | 0.73 | PIK3CG (0.51) | POLBTDP1L3MBTL1HTR6CYP1A2 | |
| SCHEMBL23023565 | 0.73 | PTGS2 (0.42) | HTR6PTGS2 | |
| SCHEMBL18122086 | 0.72 | HTR6 (0.43) | L3MBTL1HTR6PTGS2PDE10AMAPT | |
| SCHEMBL359281 | 0.71 | TYK2 (0.53) | TDP1L3MBTL1MEN1KMT2ALMNA |
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-3292107-A1 | AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES | Bayer Pharma Aktiengesellschaft (DE) | 2018-03-14 | — | — | EP | disclosed |
| WO-2016177658-A1 | AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2016-11-10 | — | — | WO | disclosed |