Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TPMT | P51580 | 1/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4764421 | 0.85 | CYP1A2 (0.38) | CYP1A2ERN1MEN1KMT2AMAPT | |
| SCHEMBL9243462 | 0.83 | ALDH1A1 (0.56) | CYP1A2MEN1KMT2AHTTMAPT | |
| SCHEMBL8041869 | 0.81 | KDM4E (0.49) | CYP1A2MEN1KMT2AHTTMAPT | |
| Hydrochloric Acid SCHEMBL29021152 | 0.79 | KDM4E (0.47) | CYP1A2MEN1KMT2AHTTMAPT | |
| SCHEMBL4292383 | 0.78 | MEN1 (0.42) | CYP1A2MEN1KMT2AMAPTKDM4E | |
| SCHEMBL3605999 | 0.78 | CYP1A2 (0.46) | CYP1A2MEN1KMT2AHTTMAPT | |
| SCHEMBL8240786 | 0.76 | MEN1 (0.43) | CYP1A2MEN1KMT2AHTTMAPT | |
| SCHEMBL25211206 | 0.76 | CYP1A2 (0.43) | CYP1A2ERN1KMT2AHTTMAPT | |
| SCHEMBL7391709 | 0.75 | ALDH1A1 (0.49) | MEN1KMT2AHTTMAPTGAA | |
| SCHEMBL11563856 | 0.75 | KMT2A (0.52) | CYP1A2MEN1KMT2AHTTMAPT |
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-1971596-A2 | FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS MINERALOCORTICOID RECEPTOR LIGANDS | Takeda Pharmaceutical Company Limited (JP) | 2008-09-24 | — | — | EP | disclosed |
| WO-2007077961-A2 | FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS MINERALOCORTICOID RECEPTOR LIGANDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-07-12 | — | — | WO | disclosed |