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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.68 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.68 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.48 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
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 SCHEMBL8025672 | 0.86 | CYP2A6 (0.50) | CYP2A6CYP2A13HSD17B3ALDH1A1ALDH3A1 | |
| Acetic Acid SCHEMBL18059862 | 0.85 | CYP2A6 (0.79) | CYP2A6CYP2A13HSD17B3ALDH1A1ALDH3A1 | |
| Urea SCHEMBL28672417 | 0.85 | CYP2A6 (0.79) | CYP2A6CYP2A13HSD17B3ALDH1A1ALDH3A1 | |
| Monoethanolamine SCHEMBL28535065 | 0.84 | CYP2A6 (0.70) | CYP2A6CYP2A13HSD17B3ALDH1A1ALDH3A1 | |
| Methyl Alcohol SCHEMBL11054490 | 0.82 | CYP2A6 (0.91) | CYP2A6CYP2A13HSD17B3ALDH1A1ALDH3A1 | |
| SCHEMBL61517 | 0.82 | CYP2A6 (1.00) | CYP2A6CYP2A13HSD17B3ALDH1A1ALDH3A1 | |
| Alcohol SCHEMBL28295447 | 0.81 | CYP2A6 (0.79) | CYP2A6CYP2A13HSD17B3ALDH1A1ALDH3A1 | |
| Water SCHEMBL28553448 | 0.80 | CYP2A6 (0.95) | CYP2A6CYP2A13HSD17B3ALDH1A1ALDH3A1 | |
| Hydrochloric Acid SCHEMBL6593779 | 0.80 | CYP2A6 (0.95) | CYP2A6CYP2A13HSD17B3ALDH1A1ALDH3A1 | |
| SCHEMBL28322492 | 0.80 | CYP2A6 (0.95) | CYP2A6CYP2A13HSD17B3ALDH1A1ALDH3A1 |
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 |