Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.54 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8174468 | 0.87 | CYP2C19 (0.56) | HTR1AADRA1DADRA1AADRA1BALDH1A1 | |
| Hydrochloric Acid SCHEMBL7601212 | 0.86 | CYP2C19 (0.55) | HTR1AADRA1DADRA1AADRA1BALDH1A1 | |
| SCHEMBL8781001 | 0.85 | TSHR (0.53) | HTR1AADRA1DADRA1AADRA1BALDH1A1 | |
| SCHEMBL6960534 | 0.85 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2HPGDTSHRCYP2D6 | |
| SCHEMBL6674437 | 0.85 | TSHR (0.59) | ALDH1A1SMN1; SMN2HPGDTSHRCYP2D6 | |
| SCHEMBL10650120 | 0.84 | TSHR (0.54) | ALDH1A1SMN1; SMN2HPGDTSHRL3MBTL1 | |
| Hydrochloric Acid SCHEMBL6961845 | 0.82 | TSHR (0.53) | ALDH1A1SMN1; SMN2HPGDTSHRL3MBTL1 | |
| SCHEMBL25662477 | 0.80 | TSHR (0.57) | ALDH1A1SMN1; SMN2HPGDTSHRL3MBTL1 | |
| SCHEMBL10645660 | 0.80 | ALDH1A1 (0.49) | HTR1AADRA1DADRA1AADRA1BALDH1A1 | |
| Hydrochloric Acid SCHEMBL30409330 | 0.79 | TSHR (0.56) | ALDH1A1SMN1; SMN2HPGDTSHRL3MBTL1 |
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-110669015-A | Preparation method of FGFR inhibitor | 上海喀露蓝科技有限公司 | 2020-01-10 | — | — | CN | disclosed |