Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | FCER2 | P06734 | 1/20 | 0.38 |
| ▸ | PTGER4 | P35408 | 4/20 | 0.37 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.37 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.36 |
| ▸ | TACR2 | P21452 | 2/20 | 0.35 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL7986625 | 0.87 | MMP1 (0.38) | TACR1MMP1FCER2PTGER4PTGER1 | |
| SCHEMBL7990393 | 0.84 | PTGER4 (0.39) | PTGER4PTGER1PTGER3CYP2A6 | |
| SCHEMBL7989529 | 0.79 | MMP9 (0.52) | TACR1 | |
| SCHEMBL7989539 | 0.79 | MMP9 (0.52) | TACR1 | |
| SCHEMBL7993921 | 0.75 | ALDH1A1 (0.39) | TACR1TACR2 | |
| SCHEMBL7993920 | 0.75 | ALDH1A1 (0.39) | TACR1TACR2 | |
| SCHEMBL7988007 | 0.73 | RAB9A (0.39) | — | |
| SCHEMBL7976201 | 0.72 | TACR1 (0.59) | TACR1 | |
| SCHEMBL7976198 | 0.72 | TACR1 (0.59) | TACR1 | |
| SCHEMBL7990402 | 0.70 | PSEN1 (0.37) | — |
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 |