Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
| ▸ | HTR1A | P08908 | 2/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 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 | |
|---|---|---|---|---|
| SCHEMBL5243882 | 0.77 | POLB (0.48) | DRD2TP53MAPTKDM4EDRD4 | |
| SCHEMBL5244476 | 0.75 | ALDH1A1 (0.44) | MAPTKDM4EDRD3POLBALDH1A1 | |
| SCHEMBL5244482 | 0.74 | ALDH1A1 (0.44) | DRD2MAPTDRD4HTR1APOLB | |
| SCHEMBL5246364 | 0.73 | DRD2 (0.51) | DRD2TP53KDM4EDRD4DRD3 | |
| SCHEMBL23613835 | 0.69 | AR (0.34) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL5249660 | 0.69 | ALDH1A1 (0.44) | MAPTKDM4EPOLBALDH1A1MEN1 | |
| SCHEMBL23176189 | 0.68 | AR (0.35) | — | |
| SCHEMBL164538 | 0.66 | LMNA (0.67) | DRD2MAPTDRD4HTR1APOLB | |
| SCHEMBL576454 | 0.66 | LMNA (0.67) | DRD2MAPTDRD4HTR1APOLB | |
| SCHEMBL576814 | 0.66 | LMNA (0.67) | DRD2MAPTDRD4HTR1APOLB |
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-1866298-A2 | HYDROXYSTEROID DEHYDROGENASE INHIBITORS | Takeda San Diego, Inc. (US) | 2007-12-19 | — | — | EP | claimed |
| WO-2006105127-A2 | HYDROXYSTEROID DEHYDROGENASE INHIBITORS | TAKEDA SAN DIEGO, INC. (US) | 2006-10-05 | — | — | WO | claimed |