Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 4/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | C5AR1 | P21730 | 3/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | TRPV6 | Q9H1D0 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5720125 | 0.87 | CHRM1 (0.41) | CHRM1DRD2KDM4EALDH1A1TRPV6 | |
| SCHEMBL5720092 | 0.86 | CHRM1 (0.51) | CHRM1DRD2KDM4EALDH1A1TRPV6 | |
| SCHEMBL5720263 | 0.84 | CHRM1 (0.38) | CHRM1DRD2KDM4EALDH1A1TRPV6 | |
| SCHEMBL5720312 | 0.84 | DRD2 (0.40) | CHRM1DRD2KDM4EALDH1A1TRPV6 | |
| SCHEMBL5720132 | 0.79 | TRPV6 (0.41) | CHRM1DRD2KDM4EALDH1A1TRPV6 | |
| SCHEMBL5719999 | 0.79 | CHRM2 (0.45) | DRD2ALDH1A1PARP1 | |
| SCHEMBL5720110 | 0.76 | TLR9 (0.40) | DRD2ALDH1A1 | |
| SCHEMBL5720388 | 0.76 | DRD2 (0.40) | DRD2KDM4ETRPV6PARP1 | |
| SCHEMBL5720128 | 0.76 | TLR7 (0.44) | DRD2ALDH1A1TRPV6PARP1 | |
| SCHEMBL4301270 | 0.76 | SLC18A3 (0.48) | CHRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1515722-A4 | OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION | MERCK & CO INC (US) | 2006-06-21 | — | — | EP | claimed |
| EP-1515722-A2 | OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION | Merck & Co., Inc. (US) | 2005-03-23 | — | — | EP | claimed |
| WO-2003105781-A2 | OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION | MERCK & CO., INC. (US) | 2003-12-24 | — | — | WO | claimed |