Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | PDE2A | O00408 | 1/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.36 |
| ▸ | CFTR | P13569 | 2/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6744668 | 1.00 | SLC18A3 (0.44) | SLC18A3SIGMAR1PDE2AOPRL1CFTR | |
| SCHEMBL6745262 | 1.00 | SLC18A3 (0.44) | SLC18A3SIGMAR1PDE2AOPRL1CFTR | |
| SCHEMBL14830564 | 0.81 | PDE2A (0.41) | SLC18A3SIGMAR1PDE2AOPRK1NR1I2 | |
| SCHEMBL1017887 | 0.81 | SLC18A3 (0.35) | SLC18A3SIGMAR1OPRL1CFTR | |
| SCHEMBL2479070 | 0.75 | HTT (0.38) | SLC18A3SIGMAR1OPRL1IDO1TDO2 | |
| SCHEMBL2472871 | 0.75 | HTT (0.38) | SLC18A3SIGMAR1OPRL1IDO1TDO2 | |
| SCHEMBL4610704 | 0.75 | ESR1 (0.43) | PDE2AOPRL1IDO1TDO2OPRM1 | |
| SCHEMBL2504578 | 0.75 | OPRL1 (0.45) | PDE2AOPRL1IDO1TDO2OPRM1 | |
| SCHEMBL4610755 | 0.75 | ESR1 (0.43) | PDE2AOPRL1IDO1TDO2OPRM1 | |
| SCHEMBL5485147 | 0.75 | PDE2A (0.54) | PDE2AOPRL1IDO1TDO2OPRM1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022040157-A1 | BORON CONTAINING COMPOUNDS AND THEIR USES | 5METIS, INC. (US) | 2022-02-24 | — | — | WO | disclosed |
| WO-2022040157-A1 | BORON CONTAINING COMPOUNDS AND THEIR USES | 5METIS, INC. (US) | 2022-02-24 | — | — | WO | disclosed |
| EP-0559743-A1 | NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE. | PFIZER HOSPITAL PROD (US) | 1993-09-15 | — | — | EP | disclosed |
| WO-1992009566-A1 | NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE | PFIZER INC. (US) | 1992-06-11 | — | — | WO | disclosed |