Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | PDE1A | P54750 | 1/20 | 0.37 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19635172 | 0.88 | MAPT (0.44) | MAPTHSD17B10PDE4DDUSP3CYP1A2 | |
| SCHEMBL19635175 | 0.88 | MAPT (0.46) | MAPTHSD17B10PDE4DDUSP3CYP1A2 | |
| SCHEMBL19634910 | 0.84 | MAPT (0.46) | MAPTHSD17B10PDE4DDUSP3CYP1A2 | |
| SCHEMBL19635473 | 0.82 | MAPT (0.44) | MAPTHSD17B10PDE4DDUSP3CYP1A2 | |
| SCHEMBL19635469 | 0.81 | MAPT (0.43) | MAPTHSD17B10PDE4DDUSP3CYP1A2 | |
| SCHEMBL15289919 | 0.81 | MAPT (0.43) | MAPTHSD17B10PDE4DDUSP3CYP1A2 | |
| SCHEMBL19634953 | 0.79 | MAPT (0.42) | MAPTHSD17B10PDE4DDUSP3CYP1A2 | |
| SCHEMBL19635530 | 0.79 | MAPT (0.42) | MAPTHSD17B10PDE4DDUSP3CYP1A2 | |
| SCHEMBL15230490 | 0.79 | PDE4D (0.56) | MAPTHSD17B10PDE4DDUSP3CYP1A2 | |
| SCHEMBL19635421 | 0.78 | HSD17B10 (0.42) | MAPTHSD17B10PDE4DDUSP3CYP1A2 |
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-2017198341-A1 | MACROCYCLIC INDOLE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2017-11-23 | — | — | WO | disclosed |