Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.46 |
| ▸ | NOS1 | P29475 | 1/20 | 0.46 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6823942 | 0.87 | NOS3 (0.46) | NOS3NOS1TPSAB1ALDH1A1KMT2A | |
| SCHEMBL6823012 | 0.85 | NPSR1 (0.42) | TPSAB1ALDH1A1MAPTPOLBRAB9A | |
| Hydrochloric Acid SCHEMBL6820134 | 0.82 | NOS3 (0.50) | NOS3NOS1TPSAB1ALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL7991650 | 0.74 | ALDH1A1 (0.64) | NOS3NOS1ALDH1A1TSHRKMT2A | |
| SCHEMBL6823459 | 0.72 | NPSR1 (0.44) | TPSAB1MAPTRAB9AKMT2AHTR2A | |
| SCHEMBL6823243 | 0.69 | RAB9A (0.40) | ALDH1A1MAPTPOLBRAB9AKMT2A | |
| SCHEMBL12133623 | 0.67 | KMT2A (0.76) | ALDH1A1MAPTPOLBRAB9AKMT2A | |
| SCHEMBL6823950 | 0.67 | DPP4 (0.45) | ALDH1A1TSHRKMT2A | |
| SCHEMBL19112444 | 0.67 | KMT2A (0.54) | MAPTPOLBKMT2AUSP2HTT | |
| Hydrochloric Acid SCHEMBL6823011 | 0.67 | NPSR1 (0.43) | TPSAB1ALDH1A1MAPTPOLBRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004067522-A1 | AZAPHENYLALANINE DERIVATIVES AND THEIR USE AS ANTITHROMBOTIC AGENTS | LEK PHARMACEUTICALS D.D. (SI) | 2004-08-12 | — | — | WO | disclosed |