Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | F12 | P00748 | 1/20 | 0.39 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 SCHEMBL9770597 | 0.99 | MCL1 (0.43) | MCL1LMNAF2F12CXCR4 | |
| SCHEMBL11733028 | 0.85 | SIRT1 (0.39) | LMNAF2F12CXCR4ALDH1A1 | |
| SCHEMBL11521291 | 0.83 | SIRT1 (0.39) | LMNAF2F12CXCR4ALDH1A1 | |
| Lithium SCHEMBL11521301 | 0.83 | SIRT1 (0.39) | LMNAF2F12CXCR4ALDH1A1 | |
| Bromide SCHEMBL11732937 | 0.82 | SIRT1 (0.38) | CXCR4POLBCYP2D6SIRT1 | |
| Bromide SCHEMBL11732930 | 0.82 | SIRT1 (0.38) | CXCR4POLBCYP2D6SIRT1 | |
| Lithium Ion SCHEMBL11521293 | 0.80 | POLB (0.33) | F2F12CXCR4POLBCYP2D6 | |
| SCHEMBL10840950 | 0.78 | POLB (0.36) | LMNACXCR4ALDH1A1HPGDL3MBTL1 | |
| SCHEMBL10841331 | 0.78 | OPRK1 (0.36) | LMNACXCR4ALDH1A1HPGDL3MBTL1 | |
| SCHEMBL9770662 | 0.78 | MCL1 (0.49) | MCL1F2F12CXCR4HTT |
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-5001131-A | Pyridine derivatives | JOHN WYETH & BROTHER LIMITED (GB) | 1991-03-19 | — | — | US | disclosed |