Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.47 |
| ▸ | CCKAR | P32238 | 2/20 | 0.41 |
| ▸ | KIT | P10721 | 2/20 | 0.40 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | CFTR | P13569 | 1/20 | 0.39 |
| ▸ | PRKCZ | Q05513 | 2/20 | 0.39 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.36 |
| ▸ | PRKCI | P41743 | 1/20 | 0.35 |
| ▸ | NEK2 | P51955 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27582134 | 0.90 | ADORA1 (0.48) | ADORA1CCKARKITMAP4K1ADORA2A | |
| SCHEMBL5405421 | 0.88 | ADORA1 (0.53) | ADORA1CCKARKITMAP4K1ADORA2A | |
| SCHEMBL5404432 | 0.85 | ADORA1 (0.52) | ADORA1CCKARKITMAP4K1ADORA2A | |
| SCHEMBL5405504 | 0.85 | PRKCZ (0.55) | ADORA1CCKARKITMAP4K1ADORA2A | |
| SCHEMBL5400730 | 0.85 | ADORA1 (0.49) | ADORA1CCKARKITMAP4K1ADORA2A | |
| SCHEMBL5401499 | 0.82 | ADORA1 (0.51) | ADORA1CCKARKDM4EALDH1A1LMNA | |
| SCHEMBL5405217 | 0.81 | ADORA1 (0.50) | ADORA1CCKARADORA2AKDM4EALDH1A1 | |
| SCHEMBL5407179 | 0.81 | ADORA1 (0.47) | ADORA1CCKARKITADORA2ACFTR | |
| SCHEMBL27582182 | 0.80 | MAPK1 (0.37) | ADORA1ADORA2AMTORALDH1A1PIK3CA | |
| SCHEMBL5404667 | 0.80 | ADORA1 (0.52) | ADORA1ADORA2AKDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-100534991-C | Heterocyclic inhibitors of ERK 2 and uses thereof | VERTEX PHARMA (US) | 2009-09-02 | — | — | CN | claimed |
| CN-1494541-A | heterocyclic inhibitors of ERK2 and uses thereof | ��̩��˹ҩ��ɷ�����˾ | 2004-05-05 | — | — | CN | claimed |