Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | TYMS | P04818 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.34 |
| ▸ | CCR2 | P41597 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
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 SCHEMBL5810686 | 0.99 | PTGDR2 (0.39) | PTGDR2TYMSSMN1; SMN2HTTNPSR1 | |
| SCHEMBL5810860 | 0.89 | KDM4E (0.38) | PTGDR2SMN1; SMN2HTTALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL5807516 | 0.89 | PTGDR2 (0.38) | PTGDR2TYMSSMN1; SMN2HTTNPSR1 | |
| Hydrochloric Acid SCHEMBL5809996 | 0.88 | KDM4E (0.37) | PTGDR2SMN1; SMN2HTTALDH1A1LMNA | |
| SCHEMBL5809806 | 0.88 | MCL1 (0.38) | PTGDR2SMN1; SMN2ALDH1A1TSHRHCRTR2 | |
| SCHEMBL5806243 | 0.86 | PTGDR2 (0.42) | PTGDR2TYMSSMN1; SMN2HTTNPSR1 | |
| Hydrochloric Acid SCHEMBL5807333 | 0.86 | MCL1 (0.38) | PTGDR2SMN1; SMN2NPSR1ALDH1A1LMNA | |
| SCHEMBL5811354 | 0.86 | MEN1 (0.42) | PTGDR2HTTALDH1A1LMNAMAPT | |
| Hydrochloric Acid SCHEMBL5808605 | 0.85 | PTGDR2 (0.41) | PTGDR2TYMSSMN1; SMN2HTTNPSR1 | |
| SCHEMBL5806009 | 0.85 | CYP1A2 (0.39) | HTTCYP1A2CYP3A4CYP2C9CYP2C19 |
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-2006025717-A1 | PYRROLO[2,3-c]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | YUHAN CORPORATION (KR) | 2006-03-09 | — | — | WO | claimed |