Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A19 | Q695T7 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 2/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | AGXT | P21549 | 2/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3647541 | 0.79 | ALDH1A1 (0.54) | ALDH1A1HSD17B3MAOBMAOASLC6A19 | |
| SCHEMBL6204379 | 0.79 | CHRM5 (0.53) | — | |
| SCHEMBL6203320 | 0.79 | RELA (0.47) | XDHIDO1AGXTEGFRMAPT | |
| SCHEMBL6204739 | 0.79 | NFE2L2 (0.49) | MAOBMAOAPKMMAPK1 | |
| SCHEMBL27663526 | 0.79 | ALDH1A1 (0.46) | ALDH1A1HSD17B3MAOBMAOASLC6A19 | |
| SCHEMBL27663529 | 0.77 | MAOB (0.53) | ALDH1A1HSD17B3MAOBMAOAIDO1 | |
| SCHEMBL5410674 | 0.77 | TRPA1 (0.39) | ALDH1A1MAOBIDO1 | |
| SCHEMBL6204838 | 0.76 | ALDH1A1 (0.47) | ALDH1A1HSD17B3MAOBMAOASLC6A19 | |
| SCHEMBL6202337 | 0.76 | TUBB4A (0.48) | ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL6204519 | 0.75 | ALDH1A1 (0.42) | ALDH1A1HSD17B3SLC6A19XDHHSD11B1 |
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-1668601-A | N-substituted tricyclic 3-aminopyrazoles as PDFG receptor inhibitors | JANSSEN PHARMACEUTICA NV (BE) | 2005-09-14 | — | — | CN | disclosed |
| 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 |