Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C4 | P17516 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.49 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | FASN | P49327 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CLK1 | P49759 | 1/20 | 0.45 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.45 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.45 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.44 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4851741 | 0.89 | RECQL (0.55) | AKR1C4AKR1C3AKR1C2AKR1C1PARP1 | |
| SCHEMBL19774168 | 0.84 | MEN1 (0.57) | AKR1C4AKR1C3AKR1C2AKR1C1PARP1 | |
| SCHEMBL1041696 | 0.83 | MAPT (0.61) | ABL1ALOX15ALDH1A1MAPTTDP1 | |
| SCHEMBL31366555 | 0.83 | MAPT (0.61) | ABL1ALOX15ALDH1A1MAPTTDP1 | |
| SCHEMBL8956721 | 0.83 | PARP1 (0.49) | ABL1PARP1ALOX15ALDH1A1SMN1; SMN2 | |
| SCHEMBL2241001 | 0.82 | MAPK1 (0.58) | ABL1ALOX15ALDH1A1HPGDALOX12 | |
| SCHEMBL8080314 | 0.80 | MAPT (0.67) | PARP1FASNALDH1A1MAPTCLK1 | |
| SCHEMBL5618019 | 0.80 | RAB9A (0.55) | ABL1PARP1ALDH1A1HPGDMAPK1 | |
| SCHEMBL11392123 | 0.78 | TSHR (0.61) | AKR1C4AKR1C3AKR1C2AKR1C1PARP1 | |
| SCHEMBL8956523 | 0.77 | ALOX15 (0.50) | PARP1ALOX15ALDH1A1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| US-6100254-A | Inhibitors of protein tyrosine kinases | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2000-08-08 | — | — | US | disclosed |
| WO-1999019306-A2 | 2,3-BENZODIAZEPIN-2-ONE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF PROTEIN TYROSINE KINASES | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 1999-04-22 | — | — | WO | disclosed |