Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.71 |
| ▸ | LMNA | P02545 | 2/20 | 0.71 |
| ▸ | MAPT | P10636 | 4/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Thiosulfuric Acid SCHEMBL11090513 | 0.90 | HPGD (0.71) | HPGDALDH1A1LMNAMAPTPOLB | |
| SCHEMBL83922 | 0.90 | HPGD (0.86) | HPGDALDH1A1LMNAMAPTPOLB | |
| SCHEMBL4800405 | 0.83 | HPGD (1.00) | HPGDALDH1A1LMNAMAPTPOLB | |
| SCHEMBL2385213 | 0.80 | HPGD (0.76) | HPGDALDH1A1LMNAMAPTPOLB | |
| SCHEMBL7110355 | 0.78 | HPGD (0.67) | HPGDALDH1A1LMNAMAPTPOLB | |
| Piperidine SCHEMBL11302904 | 0.77 | HPGD (0.66) | HPGDALDH1A1LMNAMAPTPOLB | |
| Thiosulfuric Acid SCHEMBL11092443 | 0.77 | HDAC3 (0.58) | HPGDLMNAMAPTPOLBSMN1; SMN2 | |
| Thiosulfuric Acid SCHEMBL11085950 | 0.77 | NAAA (0.54) | HPGDALDH1A1LMNAMAPTPOLB | |
| SCHEMBL4970119 | 0.77 | LMNA (0.66) | HPGDALDH1A1LMNAMAPTPOLB | |
| SCHEMBL4049341 | 0.76 | LMNA (0.69) | HPGDALDH1A1LMNAMAPTPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0018100-B1 | SUBSTITUTED AROMATIC BIOLOGICALLY ACTIVE COMPOUND, A PROCESS FOR ITS PREPARATION AND ITS USE AS BIOCIDE | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1984-01-18 | — | — | EP | disclosed |