Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | AHR | P35869 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4466164 | 0.78 | ADRA1D (0.47) | ADRA1DADRA1AADRA1BNPC1RAB9A | |
| Water SCHEMBL27443194 | 0.78 | ADRA1D (0.44) | ADRA1DADRA1AADRA1BNPC1RAB9A | |
| SCHEMBL7470034 | 0.76 | PTGDR2 (0.53) | ADRA1DADRA1AADRA1BNPC1RAB9A | |
| SCHEMBL5396495 | 0.76 | ADRA1D (0.52) | ADRA1DADRA1AADRA1BNPC1RAB9A | |
| SCHEMBL29715238 | 0.76 | ADRA1D (0.52) | ADRA1DADRA1AADRA1BNPC1RAB9A | |
| SCHEMBL28579044 | 0.75 | ADRA1A (0.55) | ADRA1DADRA1AADRA1BRAB9APTGDR2 | |
| Acetic Acid SCHEMBL7297431 | 0.75 | HDAC2 (0.49) | NPC1RAB9AALDH1A1TP53HPGD | |
| SCHEMBL7475116 | 0.74 | PTGDR2 (0.68) | ADRA1DADRA1AADRA1BKDM4EALDH1A1 | |
| SCHEMBL28304414 | 0.73 | ADRA1A (0.57) | ADRA1DADRA1AADRA1BRAB9ATP53 | |
| SCHEMBL29364998 | 0.73 | KDM4E (0.57) | NPC1RAB9AKDM4EALDH1A1TP53 |
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-2125735-B1 | 2,2,2-TRI-SUBSTITUTED ACETAMIDE DERIVATIVES AS GLUCOKINASE ACTIVATORS, THEIR PROCESS AND PHARMACEUTICAL APPLICATION | ADVINUS THERAPEUTICS PRIVATE LTD (IN) | 2012-06-27 | — | — | EP | disclosed |