Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.52 |
| ▸ | LIPG | Q9Y5X9 | 3/20 | 0.48 |
| ▸ | LIPC | P11150 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | EIF4A1 | P60842 | 1/20 | 0.44 |
| ▸ | GABRP | O00591 | 1/20 | 0.43 |
| ▸ | GABRD | O14764 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL7105697 | 0.91 | ALDH1A1 (0.49) | PLK1LIPGLIPCKDM4EALDH1A1 | |
| SCHEMBL26679370 | 0.85 | RXRA (0.50) | PLK1LIPGLIPCKDM4EALDH1A1 | |
| SCHEMBL24908522 | 0.84 | ALDH1A1 (0.54) | PLK1LIPGLIPCKDM4EALDH1A1 | |
| SCHEMBL27366276 | 0.83 | CFTR (0.54) | PLK1LIPGLIPCKDM4EALDH1A1 | |
| SCHEMBL2358405 | 0.81 | PLK1 (0.51) | PLK1KDM4EALDH1A1HPGDCES2 | |
| SCHEMBL27714380 | 0.80 | ALDH1A1 (0.50) | PLK1LIPGLIPCKDM4EALDH1A1 | |
| SCHEMBL9018659 | 0.80 | PLK1 (0.40) | PLK1CES2 | |
| SCHEMBL8477458 | 0.78 | ALDH1A1 (0.54) | LIPGLIPCKDM4EALDH1A1HPGD | |
| SCHEMBL8477461 | 0.78 | ALDH1A1 (0.54) | LIPGLIPCKDM4EALDH1A1HPGD | |
| SCHEMBL9995051 | 0.77 | ALDH1A1 (0.54) | PLK1LIPGLIPCKDM4EALDH1A1 |
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-1343751-A2 | CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-09-17 | — | — | EP | disclosed |
| WO-2002060859-A2 | CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY (US) | 2002-08-08 | — | — | WO | disclosed |