Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | FLT3 | P36888 | 2/20 | 0.31 |
| ▸ | XDH | P47989 | 1/20 | 0.31 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.30 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.30 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2467050 | 0.84 | ALDH1A1 (0.48) | ALDH1A1FLT3XDHGRIN2DGRIN3B | |
| SCHEMBL4508207 | 0.81 | TP53 (0.41) | ALDH1A1 | |
| SCHEMBL19089877 | 0.80 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL10896799 | 0.80 | MAOB (0.45) | MAOBAKT1 | |
| SCHEMBL5132867 | 0.79 | THRB (0.41) | ALDH1A1MAOB | |
| SCHEMBL7760471 | 0.79 | ALDH1A1 (0.50) | ALDH1A1PTGER1PTGER3PTGER2 | |
| SCHEMBL8758641 | 0.78 | ALDH1A1 (0.43) | ALDH1A1FLT3GRIN2DGRIN3BGRIN1 | |
| SCHEMBL76904 | 0.78 | ALDH1A1 (0.46) | ALDH1A1FLT3GRIN2DGRIN3BGRIN1 | |
| SCHEMBL29418124 | 0.78 | ALDH1A1 (0.46) | ALDH1A1FLT3GRIN2DGRIN3BGRIN1 | |
| SCHEMBL7804618 | 0.77 | S1PR1 (0.40) | POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-101346338-A | Dicarboxylic acid derivatives and their use | BAYER HEALTHCARE AG (DE) | 2009-01-14 | — | — | CN | disclosed |