Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | ESR1 | P03372 | 5/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA5A | P35218 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23859846 | 0.81 | RORC (0.46) | CA2ESR1KMT2ANPC1RORC | |
| SCHEMBL7213233 | 0.78 | ESR1 (0.59) | ESR1KMT2ANPC1RAB9ANPSR1 | |
| SCHEMBL6403369 | 0.77 | ESR1 (0.54) | CA2ESR1KMT2ANPC1RAB9A | |
| SCHEMBL3376825 | 0.76 | ESR1 (0.54) | CA2ESR1ALDH1A1KMT2APOLB | |
| Water SCHEMBL27995895 | 0.76 | CA2 (0.44) | CA2ESR1KMT2AHTTTSHR | |
| SCHEMBL27283527 | 0.74 | ESR1 (0.53) | CA2ESR1ALDH1A1KMT2APOLB | |
| SCHEMBL27701625 | 0.74 | CA2 (0.62) | CA2ESR1ALDH1A1KMT2APOLB | |
| SCHEMBL7149676 | 0.74 | ESR1 (0.39) | ESR1ALDH1A1LMNASMN1; SMN2TP53 | |
| SCHEMBL6039803 | 0.73 | CA2 (0.46) | CA2ESR1KMT2AHTTTSHR | |
| SCHEMBL6039797 | 0.73 | CA2 (0.41) | CA2ESR1KMT2ANPC1HTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1189466-C | New direct chain or cyclic urea, its preparing method and medicinal composition containing them | ADIR (FR) | 2005-02-16 | — | — | CN | disclosed |
| EP-1113014-A1 | Linear or cyclic ureas, a process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 2001-07-04 | — | — | EP | disclosed |
| CN-1301699-A | New direct chain or cyclic urea, its preparing method and medicinal composition containing them | ADIR (FR) | 2001-07-04 | — | — | CN | disclosed |