Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 5/20 | 0.47 |
| ▸ | MAOA | P21397 | 5/20 | 0.47 |
| ▸ | MAOB | P27338 | 5/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PRCP | P42785 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4541268 | 0.77 | KDM1A (0.38) | KDM1AMAOAMAOBPRCP | |
| SCHEMBL3148715 | 0.77 | KDM1A (0.47) | KDM1AMAOAMAOB | |
| SCHEMBL28180549 | 0.77 | KDM1A (0.39) | KDM1AMAOAMAOBSIGMAR1CYP3A4 | |
| Benzene SCHEMBL28485309 | 0.76 | SIGMAR1 (0.44) | SIGMAR1CYP3A4MEN1CYP2D6ALOX15 | |
| SCHEMBL7782470 | 0.76 | KDM1A (0.43) | KDM1AMAOAMAOBSIGMAR1PRCP | |
| SCHEMBL8887073 | 0.75 | KDM1A (0.38) | KDM1AMAOAMAOBSIGMAR1 | |
| SCHEMBL11295093 | 0.74 | KDM1A (0.46) | KDM1AMAOBSIGMAR1CYP3A4MEN1 | |
| SCHEMBL414650 | 0.74 | CYP3A4 (0.44) | SIGMAR1CYP3A4MEN1CYP2D6ALOX15 | |
| SCHEMBL21845155 | 0.74 | KDM1A (0.46) | KDM1AMAOBSIGMAR1CYP3A4MEN1 | |
| SCHEMBL29662225 | 0.73 | KDM1A (0.52) | KDM1AMAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2049550-A1 | METHOD FOR PRODUCING COPPER-CONTAINING ORGANOMETALLIC FRAMEWORK MATERIAL | BASF SE (DE) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008012216-A1 | METHOD FOR PRODUCING COPPER-CONTAINING ORGANOMETALLIC FRAMEWORK MATERIAL | BASF SE (DE) | 2008-01-31 | — | — | WO | disclosed |