Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | BRD4 | O60885 | 4/20 | 0.38 |
| ▸ | HPGDS | O60760 | 1/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 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 | |
|---|---|---|---|---|
| SCHEMBL4695908 | 0.90 | MTNR1A (0.42) | ALDH1A1ACSS2HPGDF2GLA | |
| SCHEMBL4697825 | 0.78 | ALDH1A1 (0.55) | ALDH1A1ACSS2TDP1SMN1; SMN2BRD4 | |
| SCHEMBL6047756 | 0.77 | MTNR1A (0.41) | ALDH1A1ACSS2BRD4MTNR1AMTNR1B | |
| SCHEMBL4696393 | 0.77 | ALDH1A1 (0.51) | ALDH1A1TDP1POLB | |
| SCHEMBL6047840 | 0.76 | ALDH1A1 (0.45) | ALDH1A1ACSS2TDP1HPGDSMN1; SMN2 | |
| SCHEMBL4696644 | 0.76 | ALDH1A1 (0.53) | ALDH1A1ACSS2TDP1SMN1; SMN2BRD4 | |
| SCHEMBL4696102 | 0.74 | ALDH1A1 (0.62) | ALDH1A1HPGDSMN1; SMN2MAPTPOLB | |
| SCHEMBL6047832 | 0.71 | ALDH1A1 (0.45) | ALDH1A1TDP1HSD17B10NPC1MAPT | |
| SCHEMBL6047783 | 0.70 | CNR2 (0.46) | ALDH1A1TDP1MAPTPOLB | |
| SCHEMBL4699300 | 0.70 | MTNR1A (0.47) | ALDH1A1ACSS2MTNR1AMTNR1BNPC1 |
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-1646614-A4 | OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION | MERCK & CO INC (US) | 2008-09-10 | — | — | EP | claimed |
| EP-1646614-A2 | OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION | Merck & Co., Inc. (US) | 2006-04-19 | — | — | EP | claimed |
| WO-2005002520-A2 | OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION | MERCK & CO., INC. (US) | 2005-01-13 | — | — | WO | claimed |