Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.46 |
| ▸ | TDO2 | P48775 | 2/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | ANPEP | P15144 | 2/20 | 0.40 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.40 |
| ▸ | MMP12 | P39900 | 1/20 | 0.40 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28767958 | 0.78 | KMT2A (0.48) | ANPEPERAP1MMP12ERAP2SMN1; SMN2 | |
| SCHEMBL1835888 | 0.77 | MMP12 (0.48) | MMP12SMN1; SMN2 | |
| SCHEMBL12630156 | 0.77 | CTSK (0.44) | MMP12SMN1; SMN2 | |
| SCHEMBL5323248 | 0.75 | S1PR1 (0.49) | SIGMAR1ANPEPERAP1ERAP2TAAR1 | |
| SCHEMBL172466 | 0.75 | S1PR1 (0.49) | SIGMAR1ANPEPERAP1ERAP2TAAR1 | |
| SCHEMBL10887167 | 0.74 | CYP1A2 (0.46) | SIGMAR1 | |
| SCHEMBL13074081 | 0.74 | MMP12 (0.57) | ANPEPERAP1MMP12ERAP2TAAR1 | |
| SCHEMBL8095896 | 0.74 | SIGMAR1 (0.46) | SIGMAR1ANPEPERAP1TAAR1 | |
| SCHEMBL16673087 | 0.74 | PRKCA (0.51) | MMP12SMN1; SMN2 | |
| SCHEMBL15581687 | 0.74 | PRSS1 (0.38) | SIGMAR1MMP12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2704568-B1 | DIAZENIUMDIOLATE CYCLOHEXYL DERIVATIVES | MERCK SHARP & DOHME (US) | 2018-01-24 | — | — | EP | disclosed |