Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 3/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.37 |
| ▸ | TLR2 | O60603 | 1/20 | 0.37 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7498817 | 1.00 | MCL1 (0.49) | MCL1FFAR1HDAC4BCL2L1ALDH1A1 | |
| SCHEMBL5762677 | 1.00 | MCL1 (0.49) | MCL1FFAR1HDAC4BCL2L1ALDH1A1 | |
| SCHEMBL7498812 | 1.00 | MCL1 (0.49) | MCL1FFAR1HDAC4BCL2L1ALDH1A1 | |
| SCHEMBL8037274 | 0.98 | MCL1 (0.48) | MCL1FFAR1HDAC4BCL2L1ALDH1A1 | |
| SCHEMBL8037272 | 0.84 | HDAC4 (0.40) | MCL1FFAR1HDAC4BCL2L1ALDH1A1 | |
| SCHEMBL3113860 | 0.84 | SLC9A1 (0.42) | MCL1FFAR1SLC9A1 | |
| SCHEMBL7507639 | 0.82 | ALDH1A1 (0.41) | MCL1ALDH1A1 | |
| SCHEMBL7573705 | 0.82 | ALDH1A1 (0.41) | MCL1ALDH1A1 | |
| SCHEMBL5762658 | 0.82 | ALDH1A1 (0.41) | MCL1ALDH1A1 | |
| SCHEMBL754814 | 0.82 | SLC6A3 (0.52) | TLR2TLR1 |
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-2000076514-A1 | CYCLOPENTYL MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 2000-12-21 | — | — | WO | disclosed |