Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.41 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.41 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | GBA1 | P04062 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11640859 | 1.00 | KDM4E (0.44) | KDM4EALDH1A1ESR1ESR2DDB1 | |
| SCHEMBL11792486 | 0.98 | KDM4E (0.43) | KDM4EALDH1A1ESR1ESR2DDB1 | |
| SCHEMBL11792482 | 0.98 | KDM4E (0.43) | KDM4EALDH1A1ESR1ESR2DDB1 | |
| SCHEMBL9674355 | 0.95 | DDB1 (0.41) | KDM4EALDH1A1ESR1ESR2DDB1 | |
| SCHEMBL9584588 | 0.85 | ESR1 (0.43) | KDM4EALDH1A1ESR1ESR2POLB | |
| SCHEMBL8230121 | 0.85 | TRPA1 (0.41) | KDM4EALDH1A1ESR1ESR2POLB | |
| SCHEMBL9584595 | 0.85 | ESR1 (0.43) | KDM4EALDH1A1ESR1ESR2POLB | |
| SCHEMBL9140291 | 0.84 | PTGS1 (0.40) | KDM4EALDH1A1ESR1ESR2HTT | |
| SCHEMBL9140288 | 0.84 | PTGS1 (0.40) | KDM4EALDH1A1ESR1ESR2HTT | |
| SCHEMBL27469218 | 0.84 | ALDH1A1 (0.42) | KDM4EALDH1A1HTTGAAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007072089-A1 | MGLUR5 ANTAGONISTIC CARBAMOYL-OXIME DERIVATIVES | RICHTER GEDEON VEGYÉSZETU GYÁR RT. (HU) | 2007-06-28 | — | — | WO | disclosed |
| US-4077999-A | ANALGESIC, SPASMOLYTIC | EGYT GYOGYSZERVEGYESZETI GYAR (HU) | 1978-03-07 | — | — | US | disclosed |