Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 4/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | CETP | P11597 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.33 |
| ▸ | ADCY10 | Q96PN6 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4978016 | 0.88 | ALDH1A1 (0.41) | ALDH1A1CYP3A4CNR1CNR2PDE4D | |
| SCHEMBL7635408 | 0.76 | KDM4E (0.38) | ALDH1A1CYP3A4HTR6POLBCNR1 | |
| SCHEMBL4978019 | 0.69 | ALDH1A1 (0.38) | ALDH1A1CYP3A4POLBCNR1CNR2 | |
| SCHEMBL4939707 | 0.68 | ALDH1A1 (0.41) | ALDH1A1TP53MAPTNPC1RAB9A | |
| SCHEMBL11296201 | 0.65 | HTR6 (0.41) | ALDH1A1TP53HTR6POLBCETP | |
| SCHEMBL17077999 | 0.61 | KMT2A (0.38) | ALDH1A1CYP3A4TP53POLBMAPT | |
| SCHEMBL1970510 | 0.60 | L3MBTL1 (0.46) | ALDH1A1CYP3A4HTR6CETPMAPT | |
| SCHEMBL2273652 | 0.59 | PSEN1 (0.49) | ALDH1A1CYP3A4MAPT | |
| SCHEMBL799386 | 0.59 | ERCC1 (0.41) | ALDH1A1HTR6CETPMAPTNPC1 | |
| SCHEMBL12680648 | 0.58 | ATM (0.33) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6455468-B1 | CHOLINE CHLORIDE; A CALCIUM-CONTAINING SALT; A POTASSIUM-CONTAINING SALT; SALICYLIC ACID; GLYCEROL; CALCIUM NITRATE OR CALCIUM CHLORIDE, POTASSIUM NITRATE OR POTASSIUM CHLORIDE | REGENTS OF THE UNIVERSITY OF MINNESOTA | 2002-09-24 | — | — | US | claimed |
| WO-2001082697-A2 | SEED TREATMENT COMPOSITION | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2001-11-08 | — | — | WO | claimed |
| US-6455468-B1 | CHOLINE CHLORIDE; A CALCIUM-CONTAINING SALT; A POTASSIUM-CONTAINING SALT; SALICYLIC ACID; GLYCEROL; CALCIUM NITRATE OR CALCIUM CHLORIDE, POTASSIUM NITRATE OR POTASSIUM CHLORIDE | REGENTS OF THE UNIVERSITY OF MINNESOTA | 2002-09-24 | — | — | US | disclosed |