Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.44 |
| ▸ | CYP2A13 | Q16696 | 8/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KCNJ1 | P48048 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2927234 | 0.85 | HRH3 (0.43) | HRH3ALDH1A1SMN1; SMN2NCF1POLB | |
| SCHEMBL4778748 | 0.83 | HRH3 (0.47) | HRH3ALDH1A1HTTSMN1; SMN2POLB | |
| SCHEMBL7678459 | 0.80 | MC4R (0.46) | HRH3ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL15415811 | 0.70 | HTT (0.51) | HRH3ALDH1A1CYP2C9ALOX15HSD17B10 | |
| SCHEMBL159991 | 0.69 | ALDH1A1 (0.53) | HRH3ALDH1A1CYP2C9ALOX15HSD17B10 | |
| SCHEMBL15467001 | 0.69 | HRH3 (0.87) | HRH3ALDH1A1CYP2C9ALOX15HSD17B10 | |
| SCHEMBL27708992 | 0.68 | ALDH1A1 (0.51) | HRH3ALDH1A1CYP2C9ALOX15HSD17B10 | |
| SCHEMBL4510267 | 0.67 | LMNA (0.42) | ALDH1A1CYP2C9ALOX15HSD17B10MEN1 | |
| SCHEMBL1481687 | 0.67 | CXCR4 (0.49) | HRH3ALDH1A1CYP2C9ALOX15HSD17B10 | |
| SCHEMBL21177124 | 0.67 | CYP2A13 (0.50) | HRH3ALDH1A1CYP2C9ALOX15HSD17B10 |
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-2008001134-A1 | 1,2,3,8,9,9A-HEXAHYDRO-7H-BENZO(DE)-1,7-NAPHTHYRIDIN-7-ONE DERIVATIVES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2008-01-03 | — | — | WO | disclosed |