Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 10/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | RAB9A | P51151 | 8/20 | 0.42 |
| ▸ | NPC1 | O15118 | 7/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.41 |
| ▸ | RELA | Q04206 | 3/20 | 0.41 |
| ▸ | STAT1 | P42224 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL167998 | 0.84 | SMN1; SMN2 (0.56) | SMN1; SMN2ALDH1A1RAB9ANPC1KMT2A | |
| Biphenyl SCHEMBL898253 | 0.73 | AKT1 (0.48) | SMN1; SMN2ALDH1A1RAB9ANPC1NFKB1 | |
| SCHEMBL2685502 | 0.72 | KDR (0.53) | SMN1; SMN2CYP11B1CYP11B2ALDH1A1RAB9A | |
| Biphenyl SCHEMBL27265356 | 0.71 | AKT1 (0.46) | SMN1; SMN2ALDH1A1RAB9ANPC1NFKB1 | |
| Pyrazole SCHEMBL28549233 | 0.71 | AKT1 (0.46) | SMN1; SMN2ALDH1A1RAB9ANPC1KMT2A | |
| SCHEMBL2689845 | 0.70 | CYP2A6 (0.54) | ALDH1A1MEN1 | |
| Aniline SCHEMBL27378375 | 0.69 | TSHR (0.50) | SMN1; SMN2ALDH1A1RAB9AKMT2AMEN1 | |
| Pyrazole SCHEMBL3981931 | 0.69 | TGFBR1 (0.47) | SMN1; SMN2ALDH1A1RAB9ANPC1KDM4E | |
| SCHEMBL13974502 | 0.69 | MAPT (0.66) | SMN1; SMN2ALDH1A1RAB9ANPC1KMT2A | |
| SCHEMBL13860436 | 0.69 | PIK3CD (0.55) | SMN1; SMN2ALDH1A1RAB9ANPC1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102241891-B | Pyrazolopyridine coumarin dye derivative and synthesis method and application thereof | CHINESE ACAD TECH INST PHYSICS | 2013-08-21 | — | — | CN | disclosed |
| CN-103131206-A | Pyrazolopyridine benzocoumarin dye derivative and synthesis method and application thereof | CHINESE ACAD TECH INST PHYSICS | 2013-06-05 | — | — | CN | disclosed |
| CN-102241891-A | pyrazolopyridine coumarin dye derivative and synthesis method and application thereof | CHINESE ACAD TECH INST PHYSICS | 2011-11-16 | — | — | CN | disclosed |