Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | XDH | P47989 | 2/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | SLC6A19 | Q695T7 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | PLEC | Q15149 | 1/20 | 0.33 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28069963 | 0.83 | ALDH1A1 (0.50) | ALDH1A1XDHHSD11B1HSD17B3MAOA | |
| SCHEMBL6205403 | 0.80 | CHRM5 (0.50) | TDP1 | |
| SCHEMBL6204213 | 0.80 | RELA (0.45) | XDHMAPTEGFR | |
| SCHEMBL6205455 | 0.76 | KDM4E (0.48) | ALDH1A1MAOAMAOBSMN1; SMN2MAPT | |
| SCHEMBL6203560 | 0.76 | ALDH1A1 (0.46) | ALDH1A1XDHHSD11B1HSD17B3MAOA | |
| SCHEMBL16618643 | 0.74 | ALDH1A1 (0.61) | ALDH1A1HSD11B1HSD17B3MAOAMAOB | |
| SCHEMBL2811422 | 0.72 | SLC6A19 (0.49) | ALDH1A1XDHHSD17B3MAOAMAOB | |
| SCHEMBL2811420 | 0.72 | SLC6A19 (0.49) | ALDH1A1XDHHSD17B3MAOAMAOB | |
| SCHEMBL18243744 | 0.71 | ALDH1A1 (0.57) | ALDH1A1HSD11B1HSD17B3MAOAMAOB | |
| SCHEMBL511200 | 0.70 | IDO1 (0.56) | ALDH1A1MAOAMAOBSMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1506175-A1 | N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-02-16 | — | — | EP | disclosed |
| WO-2003097609-A1 | N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2003-11-27 | — | — | WO | disclosed |