Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G1B | P04054 | 1/20 | 0.42 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.42 |
| ▸ | SGMS2 | Q8NHU3 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | ALPG | P10696 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ACP3 | P15309 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5864312 | 1.00 | PLA2G1B (0.42) | PLA2G1BATG4BSGMS2MEN1KMT2A | |
| SCHEMBL28384031 | 0.94 | SMN1; SMN2 (0.44) | PLA2G1BATG4BSGMS2MEN1KMT2A | |
| SCHEMBL8937823 | 0.88 | SMN1; SMN2 (0.50) | SGMS2MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL13266485 | 0.88 | SMN1; SMN2 (0.50) | SGMS2MEN1KMT2AALDH1A1SMN1; SMN2 | |
| Mandelic Acid SCHEMBL5864416 | 0.87 | ALDH1A1 (0.44) | MEN1KMT2AALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL31338915 | 0.84 | ATM (0.56) | SGMS2MEN1KMT2ASMN1; SMN2NPSR1 | |
| SCHEMBL11977412 | 0.84 | SMN1; SMN2 (0.55) | SGMS2MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL11661992 | 0.84 | SIGMAR1 (0.46) | SGMS2MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL11663577 | 0.83 | CNR2 (0.45) | SGMS2MEN1KMT2ASMN1; SMN2CNR2 | |
| SCHEMBL11984374 | 0.83 | GPBAR1 (0.47) | MEN1KMT2AALDH1A1SMN1; SMN2CNR2 |
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-6984642-B1 | Substituted phenylcyclohexane carboxylic acid amides and their use as adenosine uptake inhibitors | BAYER AKTIENGESELLSCHAFT (DE) | 2006-01-10 | — | — | US | disclosed |