Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLAU | P00749 | 4/20 | 0.56 |
| ▸ | CCR1 | P32246 | 1/20 | 0.47 |
| ▸ | CCR5 | P51681 | 1/20 | 0.47 |
| ▸ | CCR8 | P51685 | 1/20 | 0.47 |
| ▸ | ATP4A | P20648 | 5/20 | 0.43 |
| ▸ | ATP4B | P51164 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.38 |
| ▸ | HTR3B | O95264 | 2/20 | 0.38 |
| ▸ | HTR3A | P46098 | 2/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7239803 | 0.99 | PLAU (0.55) | PLAUCCR1CCR5CCR8ATP4A | |
| Hydrochloric Acid SCHEMBL7229050 | 0.85 | PLAU (0.56) | PLAUCCR1CCR5CCR8ATP4A | |
| Hydrochloric Acid SCHEMBL7240496 | 0.84 | ALDH1A1 (0.47) | PLAUCCR1CCR5CCR8MAPT | |
| Hydrochloric Acid SCHEMBL7236046 | 0.84 | PLAU (0.55) | PLAUCCR1CCR5CCR8ATP4A | |
| SCHEMBL7231676 | 0.78 | CCR1 (0.56) | PLAUCCR1CCR5CCR8MAPT | |
| SCHEMBL7232327 | 0.78 | CCR1 (0.38) | PLAUCCR1CCR5CCR8 | |
| Hydrochloric Acid SCHEMBL7229297 | 0.75 | TAAR1 (0.62) | PLAUCCR1CCR5CCR8ATP4A | |
| SCHEMBL7231484 | 0.75 | CCR1 (0.45) | PLAUCCR1CCR5CCR8MAPT | |
| SCHEMBL7834251 | 0.75 | CCR1 (0.45) | PLAUCCR1CCR5CCR8MAPT | |
| Hydrochloric Acid SCHEMBL7239801 | 0.74 | CCR1 (0.44) | PLAUCCR1CCR5CCR8MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1157022-A1 | PYRIDINE COMPOUNDS AND THEIR PHARMACEUTICAL USE | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-11-28 | — | — | EP | disclosed |
| WO-2000049015-A1 | PYRIDINE COMPOUNDS AND THEIR PHARMACEUTICAL USE | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-08-24 | — | — | WO | disclosed |