Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | GFER | P55789 | 2/20 | 0.53 |
| ▸ | NGLY1 | Q96IV0 | 1/20 | 0.53 |
| ▸ | CTSV | O60911 | 1/20 | 0.52 |
| ▸ | CTSL | P07711 | 1/20 | 0.52 |
| ▸ | FABP4 | P15090 | 1/20 | 0.51 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.48 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15679878 | 0.87 | MAPT (0.53) | MAPTGFERNGLY1CTSVCTSL | |
| SCHEMBL13401697 | 0.86 | HCAR3 (0.67) | MAPTGFERNGLY1CTSVCTSL | |
| SCHEMBL8833788 | 0.82 | MAPT (0.67) | MAPTGFERNGLY1CTSVCTSL | |
| SCHEMBL351705 | 0.79 | MAPT (0.79) | MAPTGFERNGLY1CTSVCTSL | |
| SCHEMBL9172301 | 0.77 | MAPT (0.76) | MAPTGFERNGLY1CTSVCTSL | |
| SCHEMBL9409097 | 0.75 | MAPT (0.57) | MAPTGFERNGLY1CTSVCTSL | |
| SCHEMBL19334476 | 0.72 | HCAR3 (0.47) | MAPTGFERFABP4HCAR3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL28298843 | 0.72 | MAPT (0.73) | MAPTGFERNGLY1CTSVCTSL | |
| SCHEMBL8002116 | 0.71 | MAPT (0.67) | MAPTGFERNGLY1CTSVCTSL | |
| Fenamic Acid SCHEMBL25828 | 0.71 | FABP4 (0.92) | MAPTGFERNGLY1CTSVCTSL |
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 |
|---|---|---|---|---|---|---|---|
| US-9757375-B2 | Compounds that inhibit human DNA ligases and methods of treating cancer | UNIVERSITY OF MARYLAND, BALTIMORE (US) | 2017-09-12 | — | — | US | disclosed |