Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 15/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10540791 | 0.83 | P2RX7 (0.46) | P2RX7SLC6A2SLC6A4IDO1NOTUM | |
| SCHEMBL1635491 | 0.83 | PNMT (0.54) | P2RX7SLC6A2SLC6A4IDO1NOTUM | |
| SCHEMBL2632854 | 0.82 | P2RX7 (0.49) | P2RX7SLC6A2SLC6A4 | |
| SCHEMBL29129467 | 0.82 | P2RX7 (0.44) | P2RX7SLC6A2SLC6A4IDO1NOTUM | |
| SCHEMBL4557992 | 0.82 | P2RX7 (0.44) | P2RX7SLC6A2SLC6A4IDO1NOTUM | |
| SCHEMBL488470 | 0.82 | P2RX7 (0.53) | P2RX7SLC6A2SLC6A4IDO1NOTUM | |
| SCHEMBL3283101 | 0.82 | P2RX7 (0.44) | P2RX7SLC6A2SLC6A4 | |
| SCHEMBL10978919 | 0.81 | PNMT (0.40) | P2RX7IDO1 | |
| SCHEMBL29560223 | 0.80 | IDO1 (0.55) | SLC6A2SLC6A4IDO1 | |
| SCHEMBL121915 | 0.80 | IDO1 (0.55) | SLC6A2SLC6A4IDO1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4659720-A | POULTRY ANTIPROTOZOA AGENT | MERCK & CO., INC. (US) | 1987-04-21 | — | — | US | disclosed |
| EP-0113570-B1 | 5-(AMINO OR SUBSTITUTED AMINO) IMIDAZOLES | MERCK & CO. INC. (US) | 1987-02-25 | — | — | EP | disclosed |
| EP-0009787-B2 | PROCESS FOR THE MONOHALOGENATION OF ALKYLBENZENES IN ALPHA POSITION | BAYER AG (DE) | 1986-07-09 | — | — | EP | disclosed |
| US-4532353-A | Substituted benzotrifluoride compounds as chemical intermediates and a process for their preparation | MONSANTO CO. (US) | 1985-07-30 | — | — | US | disclosed |
| EP-0113570-A1 | 5-(Amino or substituted amino) imidazoles | MERCK & CO. INC. (US) | 1984-07-18 | — | — | EP | disclosed |
| US-4331821-A | ULTRAVIOLET RADIATION OF A VAPORIZED ALKYLBENZEN AND HALOGEN GAS MIXTURE | BAYER AKTIENGESELLSCHAFT (DE) | 1982-05-25 | — | — | US | disclosed |
| EP-0009787-A2 | Process for the monohalogenation of alkylbenzenes in alpha position | BAYER AG (DE) | 1980-04-16 | — | — | EP | disclosed |