Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11161342 | 0.88 | LMNA (0.40) | KDM4ELMNAALDH1A1MAPTPKM | |
| SCHEMBL11150311 | 0.87 | CYP4F2 (0.44) | KMT2ALTA4HCA12CA1CA2 | |
| SCHEMBL11163353 | 0.84 | ALDH1A1 (0.46) | KMT2AKDM4ELMNAMEN1ALDH1A1 | |
| SCHEMBL11157669 | 0.83 | ALDH1A1 (0.52) | KMT2ALTA4HESR1KDM4ELMNA | |
| SCHEMBL11156892 | 0.76 | CYP4F2 (0.43) | KDM4ELMNAALDH1A1MAPT | |
| SCHEMBL1146416 | 0.73 | HTR2A (0.54) | MAPTPKM | |
| SCHEMBL11148393 | 0.72 | ALDH1A1 (0.49) | KMT2AESR1KDM4EMEN1ALDH1A1 | |
| SCHEMBL7276739 | 0.71 | PCNA (0.50) | EGFRKMT2ALTA4HCAMK2ATHRB | |
| SCHEMBL11148374 | 0.71 | CYP4F2 (0.38) | KMT2AKDM4EMEN1ALDH1A1 | |
| SCHEMBL11049780 | 0.70 | KMT2A (0.50) | EGFRKMT2ACA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4389416-A | DIURETICS | ABBOTT LABORATORIES (US) | 1983-06-21 | — | — | US | disclosed |