Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 10/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 10/20 | 0.46 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | PTGIR | P43119 | 1/20 | 0.42 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28382188 | 0.91 | PARP1 (0.56) | PARP1MTNR1AMTNR1BHSD17B2HSD17B1 | |
| SCHEMBL27515960 | 0.84 | ESR2 (0.52) | PARP1CES2CES1 | |
| SCHEMBL27495391 | 0.83 | MTNR1B (0.45) | PARP1MTNR1AMTNR1BHSD17B2HSD17B1 | |
| SCHEMBL27587717 | 0.80 | MTNR1A (0.46) | PARP1MTNR1AMTNR1BHSD17B2HSD17B1 | |
| SCHEMBL28844152 | 0.78 | TRPM8 (0.56) | PARP1MTNR1AMTNR1BCES2CES1 | |
| SCHEMBL15779182 | 0.77 | MTNR1A (0.46) | PARP1MTNR1AMTNR1BHSD17B2HSD17B1 | |
| SCHEMBL3470955 | 0.77 | CA1 (0.55) | PARP1CES2CES1 | |
| SCHEMBL27296095 | 0.77 | NPSR1 (0.52) | ESR1CES2 | |
| SCHEMBL22187338 | 0.77 | ESR1 (0.45) | ESR1PARP1MTNR1AMTNR1BHSD17B2 | |
| SCHEMBL27605653 | 0.77 | CYP3A4 (0.44) | ESR1PARP1MTNR1AMTNR1BHSD17B2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1539816-A | IL-8 receptor antagonists | ʷ��˿�������ȳ�ķ����˾ | 2004-10-27 | — | — | CN | disclosed |