Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 4/20 | 0.61 |
| ▸ | PDPK1 | O15530 | 4/20 | 0.61 |
| ▸ | IKBKE | Q14164 | 3/20 | 0.61 |
| ▸ | TBK1 | Q9UHD2 | 3/20 | 0.61 |
| ▸ | PIM1 | P11309 | 3/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.38 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.38 |
| ▸ | LATS1 | O95835 | 1/20 | 0.37 |
| ▸ | LATS2 | Q9NRM7 | 1/20 | 0.37 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 6/20 | 0.37 |
| ▸ | CDK9 | P50750 | 4/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.37 |
| ▸ | CDC7 | O00311 | 4/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 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 | |
|---|---|---|---|---|
| SCHEMBL18098820 | 0.81 | PDPK1 (0.48) | TGFBR1PDPK1IKBKETBK1PIM1 | |
| SCHEMBL18098840 | 0.81 | PDPK1 (0.66) | TGFBR1PDPK1IKBKETBK1 | |
| SCHEMBL12501038 | 0.77 | TGFBR1 (1.00) | TGFBR1PDPK1IKBKETBK1PIM1 | |
| SCHEMBL12501042 | 0.74 | PDPK1 (0.68) | TGFBR1PDPK1IKBKETBK1PIM1 | |
| SCHEMBL18098819 | 0.72 | DYRK1A (0.37) | CDK2GSK3BDYRK1BDYRK1A | |
| SCHEMBL5618155 | 0.69 | TGFBR1 (0.71) | TGFBR1PDPK1IKBKETBK1PIM1 | |
| SCHEMBL12501045 | 0.69 | TGFBR1 (1.00) | TGFBR1PDPK1IKBKETBK1PIM1 | |
| SCHEMBL3354801 | 0.68 | AKT1 (0.37) | TGFBR1PIM1GSK3B | |
| SCHEMBL16572576 | 0.66 | TGFBR1 (0.67) | TGFBR1PDPK1IKBKETBK1PIM1 | |
| SCHEMBL12501144 | 0.66 | IKBKE (1.00) | TGFBR1PDPK1IKBKETBK1PIM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3133074-B1 | 7-AZAINDOLE DERIVATIVES | MERCK PATENT GMBH (DE) | 2020-12-09 | — | — | EP | disclosed |