Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.46 |
| ▸ | ATM | Q13315 | 2/20 | 0.46 |
| ▸ | ITGB3 | P05106 | 8/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 8/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 2/20 | 0.44 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | P2RY2 | P41231 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1304236 | 0.93 | CTSK (0.49) | TDP1ATMITGB3ITGA2BPOLB | |
| SCHEMBL23608150 | 0.93 | CTSK (0.49) | TDP1ATMITGB3ITGA2BPOLB | |
| SCHEMBL7150850 | 0.93 | CTSK (0.49) | TDP1ATMITGB3ITGA2BPOLB | |
| Hydrochloric Acid SCHEMBL17309873 | 0.92 | CTSK (0.48) | TDP1ATMITGB3ITGA2BPOLB | |
| Hydrochloric Acid SCHEMBL8376069 | 0.92 | CTSK (0.48) | TDP1ATMITGB3ITGA2BPOLB | |
| SCHEMBL30361337 | 0.92 | CTSK (0.48) | TDP1ATMITGB3ITGA2BPOLB | |
| Acetic Acid SCHEMBL11204426 | 0.89 | ITGB3 (0.48) | TDP1ATMITGB3ITGA2BPOLB | |
| SCHEMBL3697925 | 0.89 | CTSK (0.50) | TDP1ATMITGB3ITGA2BCTSK | |
| SCHEMBL17603548 | 0.89 | CTSK (0.50) | TDP1ATMITGB3ITGA2BCTSK | |
| SCHEMBL27603642 | 0.89 | CTSK (0.50) | TDP1ATMITGB3ITGA2BCTSK |
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-6258931-B1 | SYNTHESIZING DEOXYHYPUSINE DERIVATIVE BY USING ESTER OF DIPROTECTED LYSINE, DEBLOCKING ONE NITROGEN, CONDENSING WITH 3-CYANOPROPANAL, REDUCING TO A TRIAMINE, PROTECTING FREE AMINO GROUPS, DEBLOCKING AGAIN, AND ACYLATING THE FREE AMINO GROUP | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. | 2001-07-10 | — | — | US | disclosed |