Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 4/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.40 |
| ▸ | CDK1 | P06493 | 2/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.40 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.40 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | DDR1 | Q08345 | 3/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.34 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17026772 | 0.88 | DDR1 (0.48) | KIF11HTR6DRD2HTR2AHTR2C | |
| SCHEMBL17027012 | 0.73 | KIF11 (0.43) | KIF11HTR6DRD2HTR2AHTR2C | |
| SCHEMBL17027102 | 0.70 | KIF11 (0.44) | KIF11DRD2HTR2AHTR2CCCNB2 | |
| SCHEMBL18580453 | 0.68 | SCN2B (0.42) | HTR6MEN1KMT2APTGS2KDM4E | |
| SCHEMBL17027056 | 0.68 | MEN1 (0.47) | KIF11CCNB2CDK1CCNB1GSK3B | |
| SCHEMBL17027115 | 0.67 | POLB (0.51) | HTR6DRD2MEN1KMT2ADDR1 | |
| SCHEMBL17027204 | 0.67 | IDO1 (0.45) | KIF11HTR6DRD2MEN1KMT2A | |
| SCHEMBL17026908 | 0.65 | KIF11 (0.52) | KIF11CCNB2CDK1CCNB1GSK3B | |
| SCHEMBL28906386 | 0.65 | HTR6 (0.60) | HTR6DRD2HTR2AHTR2CPTGS2 | |
| SCHEMBL17027093 | 0.65 | CYP19A1 (0.55) | MEN1KMT2AKDM4E |
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-3107910-A1 | NEW PHENYLAZETIDINE, CARBOXYLATE OR CARBOXAMIDE COMPOUNDS | INVENTIVA (FR) | 2016-12-28 | — | — | EP | disclosed |
| WO-2015124868-A1 | NEW PHENYLAZETIDINE, CARBOXYLATE OR CARBOXAMIDE COMPOUNDS | INVENTIVA (FR) | 2015-08-27 | — | — | WO | disclosed |