Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | ANPEP | P15144 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.47 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.47 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.47 |
| ▸ | PGR | P06401 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4186748 | 0.88 | KMT2A (0.56) | KMT2AHPGDALDH1A1POLBANPEP | |
| SCHEMBL4184855 | 0.88 | KMT2A (0.56) | KMT2AHPGDALDH1A1POLBANPEP | |
| SCHEMBL18426210 | 0.88 | KMT2A (0.58) | KMT2AHPGDALDH1A1POLBANPEP | |
| Pregabalin SCHEMBL16099769 | 0.83 | CACNA2D1 (0.58) | KMT2AHPGDALDH1A1ANPEPLMNA | |
| SCHEMBL6045130 | 0.82 | KMT2A (0.79) | KMT2AHPGDALDH1A1POLBANPEP | |
| SCHEMBL4191585 | 0.82 | HPGD (0.52) | KMT2AHPGDALDH1A1POLBANPEP | |
| SCHEMBL2014475 | 0.81 | HDAC3 (0.55) | KMT2AHPGDALDH1A1POLBANPEP | |
| SCHEMBL18310372 | 0.80 | KMT2A (0.56) | KMT2AHPGDALDH1A1POLBANPEP | |
| Phenformin SCHEMBL677565 | 0.80 | CACNA2D1 (0.48) | KMT2AHPGDALDH1A1ANPEPMEN1 | |
| SCHEMBL3867659 | 0.78 | KMT2A (0.57) | KMT2AHPGDALDH1A1POLBANPEP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011071520-A1 | PROCESSES FOR THE PREPARATION OF (S)-3-(AMINOMETHYL)-5-METHYLHEXANOIC ACID | DISSYMMETRIX (PVT) LTD. (IN) | 2011-06-16 | — | — | WO | disclosed |