Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 10/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | TRIM58 | Q8NG06 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10272999 | 0.76 | CYP2A6 (0.44) | KDM4ELMNACYP1A2CYP2D6HSD17B10 | |
| SCHEMBL5261148 | 0.76 | L3MBTL1 (0.41) | LMNACYP1A2CYP3A4CYP2D6HSD17B10 | |
| SCHEMBL10734095 | 0.76 | ATM (0.39) | LMNACYP1A2CYP2D6HSD17B10TDP1 | |
| SCHEMBL805576 | 0.76 | HTR3A (0.51) | HTR3AKDM4ELMNACYP1A2CYP3A4 | |
| SCHEMBL23861062 | 0.74 | HTR3A (0.50) | HTR3AKDM4ELMNACYP1A2CYP3A4 | |
| SCHEMBL30168960 | 0.74 | HTR3A (0.50) | HTR3AKDM4ELMNACYP1A2CYP3A4 | |
| SCHEMBL24175620 | 0.74 | HTR3A (0.46) | HTR3AKDM4ELMNAMAPK1KMT2A | |
| SCHEMBL11822415 | 0.71 | HTR2A (0.46) | KDM4ELMNACYP1A2CYP2D6HSD17B10 | |
| SCHEMBL29007295 | 0.71 | ADORA3 (0.59) | HTR3AKDM4ELMNACYP1A2CYP3A4 | |
| SCHEMBL26500066 | 0.71 | CYP3A4 (0.35) | LMNACYP1A2CYP3A4CYP2D6CYP2C19 |
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-2632925-A1 | N1/N2-LACTAM ACETYL-CoA CARBOXYLASE INHIBITORS | Pfizer Inc (US) | 2013-09-04 | — | — | EP | disclosed |
| WO-2012056372-A1 | N1/N2-LACTAM ACETYL-CoA CARBOXYLASE INHIBITORS | PFIZER INC. (US) | 2012-05-03 | — | — | WO | disclosed |