Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21859555 | 0.86 | TAAR1 (0.47) | MAOBCTBP2POLBACHETAAR1 | |
| SCHEMBL692554 | 0.86 | CTBP2 (0.49) | MAOBCTBP2POLBACHETAAR1 | |
| SCHEMBL17106362 | 0.81 | MAOB (0.42) | MAOBCTBP2POLBKDM4EALDH1A1 | |
| SCHEMBL20859039 | 0.81 | CTBP2 (0.45) | MAOBCTBP2POLBACHETAAR1 | |
| SCHEMBL10478213 | 0.81 | TAAR1 (0.40) | MAOBCTBP2POLBACHETAAR1 | |
| SCHEMBL12913271 | 0.81 | RIPK1 (0.52) | MAOBTAAR1KDM4E | |
| SCHEMBL19047449 | 0.80 | POLB (0.43) | MAOBCTBP2POLBACHETAAR1 | |
| SCHEMBL19006263 | 0.80 | MMP8 (0.48) | MAOBCTBP2POLBALDH1A1RECQL | |
| SCHEMBL20715896 | 0.79 | ATM (0.37) | CTBP2POLBKDM4EALDH1A1CYP3A4 | |
| SCHEMBL6552350 | 0.79 | SMN1; SMN2 (0.50) | TAAR1ALDH1A1CYP3A4RECQLLMNA |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017112617-A1 | 4-AMINO-2-(1H-PYRAZOLO[3,4-B]PYRIDIN-3-YL)-6-OXO-6,7-DIHYDRO-5H-PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES AND THE RESPECTIVE (1H-INDAZOL-3-YL) DERIVATIVES AS CGMP MODULATORS FOR TREATING CARDIOVASCULAR DISEASES | MERCK SHARP & DOHME CORP. (US) | 2017-06-29 | — | — | WO | disclosed |
| EP-0289913-B1 | PARASITICIDAL AGENT BASED ON SUBSTITUTED AMINOMETHYL HETEROCYCLES | BAYER AG (DE) | 1993-01-13 | — | — | EP | disclosed |
| US-5128368-A | Fungicides, bactericides | BAYER AKTIENGESELLSCHAFT (DE) | 1992-07-07 | — | — | US | disclosed |
| US-4988729-A | 1,3-Dioxolane fungicides, bactericides applied to the habitat | BAYER AKTIENGESELLSCHAFT (DE) | 1991-01-29 | — | — | US | disclosed |
| EP-0256367-B1 | SUBSTITUTED HYDROXY PROPYLAMINE DERIVATIVES | BAYER AG (DE) | 1990-08-29 | — | — | EP | disclosed |
| US-4845098-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1989-07-04 | — | — | US | disclosed |
| EP-0289913-A2 | Parasiticidal agent based on substituted aminomethyl heterocycles | BAYER AG (DE) | 1988-11-09 | — | — | EP | disclosed |
| EP-0256367-A1 | Substituted hydroxy propylamine derivatives | BAYER AG (DE) | 1988-02-24 | — | — | EP | disclosed |