Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 2/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 2/20 | 0.41 |
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9315354 | 0.94 | CES1 (0.46) | ALDH1A1HPGDGAAHDAC1HDAC6 | |
| SCHEMBL10943108 | 0.86 | ALDH1A1 (0.56) | ALDH1A1HPGDRAB9ANPC1PPARA | |
| SCHEMBL10942485 | 0.84 | HPGD (0.46) | ALDH1A1HPGDGAARAB9ANPC1 | |
| SCHEMBL9681735 | 0.84 | HPGD (0.47) | ALDH1A1HPGDGAAHDAC1HDAC6 | |
| SCHEMBL10384789 | 0.84 | CES1 (0.44) | HDAC1HDAC6CES2CES1POLB | |
| SCHEMBL11076353 | 0.83 | CES1 (0.45) | ALDH1A1HPGDGAAHDAC1HDAC6 | |
| Hydrochloric Acid SCHEMBL19305010 | 0.82 | MLYCD (0.42) | CES2CES1POLBLMNA | |
| SCHEMBL10384758 | 0.81 | HDAC3 (0.45) | ALDH1A1HPGDGAAPPARAHDAC1 | |
| SCHEMBL9679833 | 0.81 | PPARA (0.45) | ALDH1A1HPGDGAARAB9ANPC1 | |
| SCHEMBL9679513 | 0.79 | HDAC3 (0.48) | ALDH1A1RAB9ANPC1HDAC1HDAC6 |
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-4374984-A | Aromatic-aliphatic ketones useful as photoinitiators | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1983-02-22 | — | — | US | disclosed |