Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.62 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.55 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | CA9 | Q16790 | 2/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | TNF | P01375 | 1/20 | 0.51 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.51 |
| ▸ | ERN1 | O75460 | 3/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 4/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL32677328 | 0.85 | APP (0.81) | APPHSD17B1HSD17B2CA1CA9 | |
| SCHEMBL27159530 | 0.85 | APP (0.81) | APPHSD17B1HSD17B2CA1CA9 | |
| SCHEMBL26325135 | 0.82 | ESR1 (0.44) | APPTNFNOD1ESR1ESR2 | |
| SCHEMBL27631114 | 0.81 | HSD17B1 (0.77) | APPHSD17B1HSD17B2CA1CA9 | |
| SCHEMBL8338272 | 0.80 | APP (0.68) | APPHSD17B1HSD17B2CA1CA9 | |
| SCHEMBL23555697 | 0.80 | APP (0.72) | APPHSD17B1HSD17B2CA1CA9 | |
| SCHEMBL5768436 | 0.80 | APP (0.72) | APPHSD17B1HSD17B2CA1CA9 | |
| SCHEMBL28813263 | 0.80 | APP (0.67) | APPHSD17B1HSD17B2CA1CA9 | |
| SCHEMBL163523 | 0.79 | APP (0.71) | APPHSD17B1HSD17B2CA1CA9 | |
| SCHEMBL29766071 | 0.79 | APP (0.71) | APPHSD17B1HSD17B2CA1CA9 |
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-7557110-B2 | MAPKAP-K2; inflammatory disease, autoimmune disease, destructive bone disorder, cancer and/or tumour growth; 5-[(trans-4-aminocyclohexyl)amino]-3-fluoro-6-methyl(pyrazolo[1,5-a]pyri- midin-7-yl)}(4-iodophenyl)amine | TEIJIN PHARMA LIMITED (JP) | 2009-07-07 | — | — | US | disclosed |