Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 2/20 | 0.52 |
| ▸ | DBF4 | Q9UBU7 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | GRM6 | O15303 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | DHODH | Q02127 | 2/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28109263 | 0.89 | CDC7 (0.52) | CDC7DBF4TSHRALDH1A1MAPT | |
| SCHEMBL21056853 | 0.82 | ALDH1A1 (0.54) | CDC7DBF4TSHRALDH1A1MAPT | |
| SCHEMBL31083364 | 0.82 | FNTA (0.55) | TSHRALDH1A1MAPTKDM4EHPGD | |
| SCHEMBL1213901 | 0.81 | CASP1 (0.52) | CDC7DBF4TSHRALDH1A1MAPT | |
| SCHEMBL20806339 | 0.80 | TSHR (0.58) | CDC7DBF4TSHRALDH1A1MAPT | |
| SCHEMBL31083341 | 0.79 | SLC22A12 (0.49) | TSHRALDH1A1MAPTKDM4EHPGD | |
| SCHEMBL873827 | 0.78 | CASP1 (0.52) | CDC7DBF4TSHRALDH1A1KDM4E | |
| SCHEMBL5778875 | 0.77 | ALDH1A1 (0.53) | TSHRALDH1A1MAPTKDM4EHPGD | |
| SCHEMBL11382394 | 0.77 | ALOX5 (0.49) | CDC7DBF4TSHRALDH1A1MAPT | |
| SCHEMBL31083564 | 0.77 | SLC22A12 (0.51) | TSHRALDH1A1MAPTKDM4ENPSR1 |
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-1400513-B1 | UNSYMMETRICAL CYCLIC DIAMINE COMPOUND | KOWA CO (JP) | 2008-01-09 | — | — | EP | disclosed |
| EP-1400513-A1 | UNSYMMETRICAL CYCLIC DIAMINE COMPOUND | Kowa Co., Ltd. (JP) | 2004-03-24 | — | — | EP | disclosed |