Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D
The experimentally established mechanism targets of Glycine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.43 |
| ▸ | TTR | P02766 | 3/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 2/20 | 0.41 |
| ▸ | EEF2K | O00418 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Cyclohexylamine SCHEMBL7802316 | 0.85 | CYP2C9 (0.36) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| SCHEMBL143965 | 0.84 | CYP2C9 (0.56) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| Glycine SCHEMBL8218439 | 0.79 | GLRA1 (0.42) | CYP2C9CYP3A4CYP1A2CYP2D6PTGS1 | |
| Benzaldehyde SCHEMBL27604595 | 0.77 | PTGS1 (0.66) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| SCHEMBL1984171 | 0.76 | HMGB1 (0.55) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| SCHEMBL13851317 | 0.75 | KDM4E (0.54) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| SCHEMBL4755669 | 0.74 | CYP2C9 (0.43) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| SCHEMBL299751 | 0.74 | EGFR (0.53) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| SCHEMBL29459683 | 0.74 | EGFR (0.53) | CYP2C9CYP3A4CYP1A2CYP2D6CYP2B6 | |
| Glycine SCHEMBL8218503 | 0.74 | ALDH1A1 (0.53) | CYP2C9CYP1A2TTRMAPTNPC1 |
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-6121054-A | DIVIDING FLUIDS AND PRECIPITATES; POSITIONING MULTICOMPARTMENT VESSELS ON SUPPORTS, SPINNING A CENTRIFUGE, ALLOWING PRECIPITATES TO SEDIMENT INTO VESSELS, EXCESS FLUIDS WILL BE EJECTED FROM THE TOP OF THE VESSEL | TREGA BIOSCIENCES, INC. (US) | 2000-09-19 | — | — | US | disclosed |