Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | FNTA | P49354 | 9/20 | 0.45 |
| ▸ | FNTB | P49356 | 9/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CCR3 | P51677 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL8573445 | 1.00 | PARP1 (0.52) | PARP1POLBFNTAFNTBHCRTR1 | |
| SCHEMBL8578507 | 0.91 | PARP1 (0.51) | PARP1POLBFNTAFNTBHCRTR1 | |
| SCHEMBL8578509 | 0.91 | PARP1 (0.51) | PARP1POLBFNTAFNTBHCRTR1 | |
| SCHEMBL8576502 | 0.91 | PARP1 (0.50) | PARP1POLBFNTAFNTBHCRTR1 | |
| SCHEMBL8453359 | 0.86 | FNTA (0.59) | PARP1POLBFNTAFNTB | |
| SCHEMBL8453364 | 0.86 | FNTA (0.59) | PARP1POLBFNTAFNTB | |
| SCHEMBL8574983 | 0.82 | FNTA (0.58) | PARP1POLBFNTAFNTBHCRTR1 | |
| SCHEMBL8574986 | 0.82 | FNTA (0.58) | PARP1POLBFNTAFNTBHCRTR1 | |
| SCHEMBL9218121 | 0.78 | PARP1 (0.47) | PARP1POLBFNTAFNTBHCRTR1 | |
| SCHEMBL5740252 | 0.78 | FNTA (0.51) | PARP1POLBFNTAFNTB |
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 |