Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | KAT6A | Q92794 | 2/20 | 0.37 |
| ▸ | ACLY | P53396 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.34 |
| ▸ | FLT3 | P36888 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 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 | |
|---|---|---|---|---|
| SCHEMBL3664241 | 0.86 | ACLY (0.43) | SRCALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL13460984 | 0.86 | ACLY (0.43) | SRCALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL3669859 | 0.82 | ALDH1A1 (0.39) | SRCCYP3A4ALDH1A1HPGDTSHR | |
| SCHEMBL3664606 | 0.82 | ALDH1A1 (0.37) | SRCCYP3A4ALDH1A1HPGDTSHR | |
| SCHEMBL675829 | 0.82 | SRC (0.45) | SRCACLYHTR6 | |
| SCHEMBL674230 | 0.80 | HTR6 (0.44) | ALDH1A1HPGDTSHRHTR6MAPT | |
| SCHEMBL675276 | 0.79 | HTR6 (0.43) | SRCALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL676078 | 0.79 | ALDH1A1 (0.40) | SRCALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL676831 | 0.79 | ALDH1A1 (0.38) | SRCALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL675428 | 0.79 | SRC (0.41) | SRCALDH1A1HPGDACLYMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2161271-A1 | Alpha-carboline inhibitors of NMP-ALK, RET, and Bcr-Abl | Università Degli Studi Di Milano - Bicocca (IT) | 2010-03-10 | — | — | EP | disclosed |