Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D
The experimentally established mechanism targets of Alanine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BHMT | Q93088 | 2/20 | 0.33 |
| ▸ | BHMT2 | Q9H2M3 | 1/20 | 0.32 |
| ▸ | MARS1 | P56192 | 2/20 | 0.31 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
| ▸ | METAP1 | P53582 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3995868 | 0.94 | BHMT (0.35) | BHMTBHMT2MARS1METAP2METAP1 | |
| Alanine SCHEMBL1409244 | 0.90 | BHMT (0.32) | BHMTBHMT2MARS1METAP2METAP1 | |
| Glycine SCHEMBL4005389 | 0.84 | BHMT (0.40) | BHMTBHMT2MARS1 | |
| SCHEMBL692980 | 0.83 | BHMT (0.31) | BHMTBHMT2 | |
| SCHEMBL5707660 | 0.79 | METAP2 (0.40) | BHMTBHMT2MARS1METAP2METAP1 | |
| SCHEMBL2260606 | 0.79 | RNPEP (0.44) | BHMTBHMT2MARS1 | |
| Glycine SCHEMBL6361607 | 0.78 | BHMT (0.36) | BHMTBHMT2METAP2METAP1 | |
| SCHEMBL17559246 | 0.77 | PTGS1 (0.41) | — | |
| SCHEMBL8655643 | 0.77 | GSR (0.45) | BHMTBHMT2 | |
| SCHEMBL9755602 | 0.77 | BHMT (0.34) | BHMTBHMT2MARS1METAP2METAP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070264627-A1 | Retrovirus from the HIV group and its use | DADE BEHRING MARBURG GMBH | 2007-11-15 | — | — | US | claimed |
| US-20070105219-A1 | Retrovirus from the HIV group and its use | DADE BEHRING MARBURG GMBH | 2007-05-10 | — | — | US | claimed |