Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 6/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2204998 | 0.87 | HTT (0.69) | HTTALDH1A1LMNAHPGDPOLB | |
| SCHEMBL9730975 | 0.84 | HTT (0.70) | HTTALDH1A1LMNAHPGDPOLB | |
| SCHEMBL15176755 | 0.79 | HTT (0.75) | HTTALDH1A1LMNAHPGDPOLB | |
| SCHEMBL619633 | 0.78 | HTT (1.00) | HTTALDH1A1LMNAHPGDPOLB | |
| SCHEMBL30270528 | 0.78 | HTT (1.00) | HTTALDH1A1LMNAHPGDPOLB | |
| SCHEMBL23781330 | 0.78 | HTT (0.77) | HTTALDH1A1LMNAHPGDPOLB | |
| SCHEMBL4286520 | 0.76 | HTT (0.75) | HTTALDH1A1LMNAHPGDPOLB | |
| SCHEMBL10866341 | 0.76 | HTT (0.52) | HTTALDH1A1LMNAPOLB | |
| SCHEMBL4290674 | 0.76 | HTT (0.61) | HTTALDH1A1LMNAHPGDPOLB | |
| SCHEMBL7096246 | 0.76 | HTR1A (0.58) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4613598-A | HYPOTENSIVE AGENTS | MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) | 1986-09-23 | — | — | US | disclosed |
| EP-0154969-A2 | Piperazine derivatives and their acid addition salts | MITSUBISHI KASEI CORPORATION (JP) | 1985-09-18 | — | — | EP | disclosed |