Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | MYC | P01106 | 3/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.44 |
| ▸ | STAT1 | P42224 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | RORC | P51449 | 2/20 | 0.43 |
| ▸ | BCL2 | P10415 | 1/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17782553 | 0.85 | BCL2 (0.59) | ALDH1A1TSHRMAPTHTTMYC | |
| SCHEMBL9023741 | 0.83 | TSHR (0.72) | ALDH1A1TSHRMAPTHTTMYC | |
| SCHEMBL17782595 | 0.83 | ELANE (0.59) | TSHRPOLBAPEX1TDP1L3MBTL1 | |
| SCHEMBL7421574 | 0.80 | SCN9A (0.58) | ALDH1A1TSHRMAPTHTTSCN9A | |
| SCHEMBL17782667 | 0.79 | BCL2 (0.62) | ALDH1A1TSHRMAPTMYCBCL2 | |
| SCHEMBL4056138 | 0.77 | CYP1A2 (0.42) | ALDH1A1TSHRSCN9ASTAT1RORC | |
| SCHEMBL30572213 | 0.76 | CYP1A2 (0.60) | ALDH1A1TSHRSTAT1RORCCYP1A2 | |
| SCHEMBL9484257 | 0.76 | CYP1A2 (0.60) | ALDH1A1TSHRSTAT1RORCCYP1A2 | |
| SCHEMBL9025523 | 0.76 | RORC (0.56) | ALDH1A1CA12CA9SCN9ASTAT1 | |
| SCHEMBL16207551 | 0.74 | TSHR (0.72) | ALDH1A1TSHRMAPTHTTMYC |
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 |
|---|---|---|---|---|---|---|---|
| EP-0347749-B1 | Pyrazoloacridone derivatives with anti-tumoral activity | KYOWA HAKKO KOGYO KK (JP) | 1996-04-24 | — | — | EP | disclosed |
| US-5079358-A | Humans; leukemia | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1992-01-07 | — | — | US | disclosed |
| EP-0347749-A2 | Pyrazoloacridone derivatives with anti-tumoral activity | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1989-12-27 | — | — | EP | disclosed |