Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 3/20 | 0.42 |
| ▸ | DPP4 | P27487 | 2/20 | 0.41 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.41 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7990399 | 1.00 | OPRD1 (0.42) | OPRD1DPP4DPP8DPP9SMN1; SMN2 | |
| SCHEMBL7990061 | 0.81 | NLN (0.49) | ALDH1A1MEN1MAPTKMT2AMMP9 | |
| SCHEMBL21309817 | 0.80 | OPRD1 (0.49) | OPRD1DPP4DPP8DPP9SMN1; SMN2 | |
| SCHEMBL7989362 | 0.79 | KDM4E (0.55) | SMN1; SMN2MEN1MAPTKMT2AMMP9 | |
| SCHEMBL7990393 | 0.77 | PTGER4 (0.39) | CYP2A6ALOX5 | |
| SCHEMBL7988010 | 0.76 | ALOX5 (0.37) | OPRD1SMN1; SMN2ALDH1A1TAAR1MEN1 | |
| SCHEMBL24709579 | 0.74 | CYP2A6 (0.53) | OPRD1DPP4DPP8DPP9SMN1; SMN2 | |
| SCHEMBL514508 | 0.72 | CYP2A6 (0.54) | OPRD1DPP4DPP8DPP9SMN1; SMN2 | |
| SCHEMBL514509 | 0.72 | CYP2A6 (0.54) | OPRD1DPP4DPP8DPP9SMN1; SMN2 | |
| SCHEMBL1421072 | 0.72 | CYP2A6 (0.54) | OPRD1DPP4DPP8DPP9SMN1; SMN2 |
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-2001040198-A2 | MACROCYCLIC HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS ANTIMICROBIAL AGENTS | AVENTIS PHARMA S.A. (FR) | 2001-06-07 | — | — | WO | disclosed |