Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TPMT | P51580 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | PPARA | Q07869 | 2/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.39 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.39 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.39 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL692554 | 0.83 | CTBP2 (0.49) | KDM4EL3MBTL1LMNACYP2C9TDP1 | |
| SCHEMBL563644 | 0.83 | PARP10 (0.42) | KDM4EL3MBTL1TPMTCYP1A2TDP1 | |
| SCHEMBL4457891 | 0.81 | BLM (0.47) | KDM4EL3MBTL1CYP2C9CYP1A2TDP1 | |
| SCHEMBL19182702 | 0.79 | KDM4E (0.41) | KDM4EL3MBTL1LMNACYP2C9CYP1A2 | |
| SCHEMBL14740848 | 0.77 | CYP1A2 (0.45) | KDM4EL3MBTL1LMNACYP1A2TDP1 | |
| SCHEMBL11259816 | 0.76 | ALDH1A1 (0.59) | KDM4ELMNACYP2C9CYP1A2TDP1 | |
| SCHEMBL20032520 | 0.76 | CNR2 (0.42) | KDM4EL3MBTL1PGK1PGK2MAPT | |
| SCHEMBL517462 | 0.76 | SMN1; SMN2 (0.57) | LMNACYP2C9CYP1A2PPARAPPARG | |
| SCHEMBL29368049 | 0.75 | CYP1A2 (0.44) | KDM4EL3MBTL1LMNACYP1A2TDP1 | |
| SCHEMBL22921518 | 0.75 | PPARA (0.48) | KDM4EL3MBTL1CYP2C9CYP1A2TDP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020139636-A1 | (PYRIDIN-2-YL)AMINE DERIVATIVES AS TGF-BETA R1 (ALK5) INHIBITORS FOR THE TREATMENT OF CANCER | NEXYS THERAPEUTICS, INC. (US) | 2020-07-02 | — | — | WO | disclosed |