Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | CCR3 | P51677 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | HTT | P42858 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | BCHE | P06276 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | CHIA | Q9BZP6 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11822913 | 0.86 | SIGMAR1 (0.47) | ALDH1A1CCR3KDM4ESIGMAR1DRD2 | |
| SCHEMBL11828871 | 0.86 | LMNA (0.52) | CCR3ACHESIGMAR1DRD2DRD4 | |
| SCHEMBL11825414 | 0.85 | DRD2 (0.61) | ALDH1A1POLBKDM4EMAPTKMT2A | |
| SCHEMBL11550343 | 0.81 | POLB (0.59) | ALDH1A1POLBKDM4EMAPTKMT2A | |
| SCHEMBL28788491 | 0.80 | HTT (0.56) | ALDH1A1POLBKDM4EMAPTKMT2A | |
| SCHEMBL9778562 | 0.78 | MAPT (0.50) | ALDH1A1POLBKDM4EMAPTKMT2A | |
| SCHEMBL26508424 | 0.78 | HTR2A (0.68) | ALDH1A1POLBKDM4EMAPTKMT2A | |
| SCHEMBL946711 | 0.78 | MAPT (0.67) | ALDH1A1POLBKDM4EMAPTKMT2A | |
| SCHEMBL11333760 | 0.78 | DRD2 (0.69) | ALDH1A1POLBKDM4EMAPTKMT2A | |
| SCHEMBL11679502 | 0.77 | HTT (0.54) | ALDH1A1POLBKDM4EMAPTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-3933824-A | Piperazinobutyrophenone derivatives | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1976-01-20 | — | — | US | disclosed |