Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | PLAU | P00749 | 2/20 | 0.51 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.51 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.51 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | CASP3 | P42574 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.49 |
| ▸ | NQO2 | P16083 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL26903783 | 0.80 | CES2 (0.68) | ALDH1A1TDP1PLAUNPC1RAB9A | |
| SCHEMBL29462782 | 0.80 | CES2 (0.68) | ALDH1A1TDP1PLAUNPC1RAB9A | |
| SCHEMBL546633 | 0.80 | CES2 (0.68) | ALDH1A1TDP1PLAUNPC1RAB9A | |
| O-Tolylamine SCHEMBL9317037 | 0.80 | NPC1 (0.51) | ALDH1A1TDP1PLAUNPC1RAB9A | |
| SCHEMBL7567274 | 0.79 | LCK (0.61) | ALDH1A1PLAUAKR1C3NPC1CASP3 | |
| Hydrochloric Acid SCHEMBL8169297 | 0.79 | CES2 (0.65) | ALDH1A1TDP1PLAUNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL22558829 | 0.79 | CES2 (0.65) | ALDH1A1TDP1PLAUNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL8358165 | 0.79 | CES2 (0.65) | ALDH1A1TDP1PLAUNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL30932950 | 0.79 | CES2 (0.65) | ALDH1A1TDP1PLAUNPC1RAB9A | |
| Betanaphthol SCHEMBL11037634 | 0.78 | ALDH1A1 (0.60) | ALDH1A1ADRA2BPTGS1TDP1GRIN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0524941-A4 | — | — | 1994-08-31 | — | — | EP | disclosed |
| EP-0524941-A1 | MONOAZO PIGMENT COMPOSITIONS. | SUN CHEMICAL CORP (US) | 1993-02-03 | — | — | EP | disclosed |
| WO-1991014744-A1 | MONOAZO PIGMENT COMPOSITIONS | SUN CHEMICAL CORPORATION (US) | 1991-10-03 | — | — | WO | disclosed |
| US-5024698-A | Axomethine containing printing ink | SUN CHEMICAL CORPORATION (US) | 1991-06-18 | — | — | US | disclosed |