Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | S100A4 | P26447 | 1/20 | 0.36 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.36 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.36 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.36 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TNKS | O95271 | 1/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7141811 | 0.90 | NPC1 (0.39) | ALDH1A1SMN1; SMN2BCHEACHENPC1 | |
| SCHEMBL6846960 | 0.81 | HRH3 (0.42) | ALDH1A1TSHRLMNATP53HPGD | |
| SCHEMBL6850903 | 0.80 | NPC1 (0.41) | ALDH1A1NPC1RAB9AHPGDCASP6 | |
| SCHEMBL6849657 | 0.79 | HPGD (0.47) | ALDH1A1SMN1; SMN2HPGDP2RX7 | |
| SCHEMBL6853121 | 0.78 | SMN1; SMN2 (0.43) | ALDH1A1GAASMN1; SMN2LMNANPC1 | |
| SCHEMBL6847114 | 0.76 | L3MBTL1 (0.42) | ALDH1A1TSHRLMNANPC1RAB9A | |
| SCHEMBL6850901 | 0.75 | CCNA2 (0.42) | ALDH1A1SMN1; SMN2LMNAHPGD | |
| SCHEMBL6850967 | 0.74 | PKM (0.52) | ALDH1A1LMNANPC1RAB9AHPGD | |
| SCHEMBL6851398 | 0.74 | KMT2A (0.40) | ALDH1A1LMNAHPGDP2RX7 | |
| SCHEMBL6849675 | 0.71 | ALDH1A1 (0.41) | ALDH1A1LMNAHPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6437147-B1 | FOR THERAPY OF DISEASES OF CENTRAL NERVOUS SYSTEM, PERIPHERAL NERVOUS SYSTEM, CARDIOVASCULAR SYSTEM, PULMONARY SYSTEM, GASTROINTESTINAL SYSTEM AND ENDOCRINOLOGICAL SYSTEM | NOVO NORDISK (DK) | 2002-08-20 | — | — | US | disclosed |