Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.41 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | FNTA | P49354 | 6/20 | 0.40 |
| ▸ | FNTB | P49356 | 6/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | CCR3 | P51677 | 2/20 | 0.37 |
| ▸ | CXCR3 | P49682 | 3/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8573446 | 0.91 | PARP1 (0.52) | PARP1POLBKDM4EHCRTR1HCRTR2 | |
| SCHEMBL8573445 | 0.91 | PARP1 (0.52) | PARP1POLBKDM4EHCRTR1HCRTR2 | |
| SCHEMBL8578507 | 0.89 | PARP1 (0.51) | PARP1POLBKDM4EHCRTR1HCRTR2 | |
| SCHEMBL8578509 | 0.89 | PARP1 (0.51) | PARP1POLBKDM4EHCRTR1HCRTR2 | |
| SCHEMBL8574801 | 0.86 | FNTA (0.51) | PARP1POLBFNTAFNTBALDH1A1 | |
| SCHEMBL6056523 | 0.78 | FNTA (0.62) | HCRTR1HCRTR2HTR2AHTR2CFNTA | |
| Hydrochloric Acid SCHEMBL9214284 | 0.77 | FNTA (0.62) | HCRTR1HCRTR2HTR2AHTR2CFNTA | |
| SCHEMBL8453359 | 0.77 | FNTA (0.59) | PARP1POLBFNTAFNTBALDH1A1 | |
| SCHEMBL8453364 | 0.77 | FNTA (0.59) | PARP1POLBFNTAFNTBALDH1A1 | |
| SCHEMBL8576156 | 0.77 | FNTA (0.51) | PARP1FNTAFNTBMGLLALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5736539-A | ANITCARCINOGENIC AGENTS | MERCK & CO., INC. (US) | 1998-04-07 | — | — | US | disclosed |
| WO-1995000497-A1 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1995-01-05 | — | — | WO | disclosed |