Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.38 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | G6PD | P11413 | 1/20 | 0.36 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21229247 | 0.74 | NTRK1 (0.36) | CASP6KDM4EMEN1ALDH1A1POLB | |
| SCHEMBL5804362 | 0.72 | KDM4E (0.68) | KDM4EMEN1ALDH1A1POLBGAA | |
| SCHEMBL18352529 | 0.71 | NTRK1 (0.36) | POLBL3MBTL1BRD4RIPK1GRIN1 | |
| SCHEMBL16935985 | 0.71 | NTRK1 (0.36) | POLBTDP1L3MBTL1RIPK1SPR | |
| SCHEMBL19613847 | 0.71 | NTRK1 (0.39) | KDM4EMAPT | |
| SCHEMBL21229436 | 0.71 | SMPD3 (0.55) | — | |
| SCHEMBL16935984 | 0.70 | TGFBR1 (0.40) | KDM4EMEN1ALDH1A1GAAMAPT | |
| SCHEMBL16946723 | 0.70 | NTRK1 (0.50) | — | |
| SCHEMBL1095844 | 0.69 | CASP6 (0.51) | CASP6HDAC1MEN1MAPTKMT2A | |
| SCHEMBL18352547 | 0.69 | NTRK1 (0.51) | — |
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-106170289-A | Diaryl macrocycles as modulators of protein kinases | TP生物医药公司 | 2016-11-30 | — | — | CN | disclosed |