Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.40 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.40 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | GFER | P55789 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 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 | |
|---|---|---|---|---|
| SCHEMBL65464 | 0.88 | ALDH1A1 (0.44) | CYP3A4ALDH1A1TDP1TSHRCA14 | |
| SCHEMBL11823197 | 0.80 | ALDH1A1 (0.56) | CYP3A4ALDH1A1TDP1TSHRMAPK1 | |
| SCHEMBL28834471 | 0.78 | MEN1 (0.44) | CYP3A4ALDH1A1TDP1MAPK1KMT2A | |
| SCHEMBL6798626 | 0.78 | ALDH1A1 (0.37) | CYP3A4ALDH1A1TDP1TSHRCA14 | |
| SCHEMBL9734606 | 0.76 | CYP3A4 (0.62) | CYP3A4ALDH1A1TDP1TSHRCYP17A1 | |
| SCHEMBL1955059 | 0.76 | ALDH1A1 (0.47) | ALDH1A1TDP1CA2L3MBTL1TP53 | |
| SCHEMBL6362775 | 0.73 | CYP3A4 (1.00) | CYP3A4ALDH1A1TDP1TSHRCA12 | |
| 4,4'-Methylenedianiline SCHEMBL28001 | 0.73 | CYP3A4 (1.00) | CYP3A4ALDH1A1TDP1TSHRCA12 | |
| SCHEMBL1304762 | 0.73 | CYP3A4 (1.00) | CYP3A4ALDH1A1TDP1TSHRCA12 | |
| SCHEMBL8094139 | 0.73 | CYP3A4 (1.00) | CYP3A4ALDH1A1TDP1TSHRCA12 |
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 |
|---|---|---|---|---|---|---|---|
| JP-7267918-A | — | — | None | — | — | JP | disclosed |
| JP-H07267918-A | 4,4'-BIS(4-(P-TOLUENESULFONYLAMINOCARBONYLAMINO) PHENYLMETHYL)DIPHENYLUREA | NEW OJI PAPER CO LTD | 1995-10-17 | — | — | JP | disclosed |