Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CARM1 | Q86X55 | 1/20 | 0.43 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.43 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.34 |
| ▸ | COL1A1 | P02452 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MC4R | P32245 | 2/20 | 0.34 |
| ▸ | MC3R | P41968 | 2/20 | 0.34 |
| ▸ | MC1R | Q01726 | 2/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21409412 | 0.73 | CARM1 (0.54) | CARM1PRMT6AGTR2EPHX2BCHE | |
| SCHEMBL1162325 | 0.73 | BDKRB2 (0.43) | CARM1PRMT6EPHX2ALDH1A1KDM4E | |
| SCHEMBL21409115 | 0.72 | CARM1 (0.48) | CARM1PRMT6EPHX2BCHEALDH1A1 | |
| SCHEMBL5067770 | 0.69 | DPP4 (0.35) | ALDH1A1CHRM2CHRM1CHRM3 | |
| SCHEMBL2980458 | 0.69 | ABCB1 (0.57) | ALDH1A1MC4RMC3RMC1R | |
| SCHEMBL18668584 | 0.68 | S1PR1 (0.46) | ALDH1A1KDM4EACHECHRM2CHRM1 | |
| SCHEMBL18668583 | 0.68 | S1PR1 (0.46) | ALDH1A1KDM4EACHECHRM2CHRM1 | |
| SCHEMBL17274394 | 0.68 | CARM1 (0.44) | CARM1PRMT6EPHX2ALDH1A1KDM4E | |
| SCHEMBL6274182 | 0.68 | GNAI3 (0.41) | BCHE | |
| SCHEMBL24493334 | 0.67 | CARM1 (0.68) | CARM1PRMT6EPHX2ALDH1A1HRH3 |
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-3774804-A1 | N-(3-(7H-PYRROLO[2,3-D]PYRIMIDIN-4-YL)PHENYL)BENZAMIDE DERIVATIVES | Novartis AG (CH) | 2021-02-17 | — | — | EP | disclosed |
| WO-2019186343-A1 | N-(3-(7H-PYRROLO[2,3-D]PYRIMIDIN-4-YL)PHENYL)BENZAMIDE DERIVATIVES | NOVARTIS AG (CH) | 2019-10-03 | — | — | WO | disclosed |