Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.71 |
| ▸ | TSHR | P16473 | 1/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | STAT1 | P42224 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| Aes-103 SCHEMBL28744511 | 0.86 | ALDH1A1 (0.81) | ALDH1A1TSHRSMN1; SMN2POLBLMNA | |
| Aes-103 SCHEMBL14809554 | 0.84 | ALDH1A1 (0.67) | ALDH1A1TSHRSMN1; SMN2POLBLMNA | |
| Aes-103 SCHEMBL31307749 | 0.84 | — | — | |
| SCHEMBL8612650 | 0.84 | ALDH1A1 (0.47) | ALDH1A1TSHRSMN1; SMN2POLBLMNA | |
| Aes-103 SCHEMBL17513182 | 0.83 | ALDH1A1 (0.88) | ALDH1A1TSHRSMN1; SMN2POLBLMNA | |
| Aes-103 SCHEMBL3053025 | 0.83 | ALDH1A1 (0.69) | ALDH1A1TSHRSMN1; SMN2POLBLMNA | |
| Aes-103 SCHEMBL17872171 | 0.82 | ALDH1A1 (0.96) | ALDH1A1TSHRSMN1; SMN2POLBLMNA | |
| Aes-103 SCHEMBL31307061 | 0.82 | ALDH1A1 (0.96) | ALDH1A1TSHRSMN1; SMN2POLBLMNA | |
| Aes-103 SCHEMBL1248422 | 0.82 | ALDH1A1 (0.96) | ALDH1A1TSHRSMN1; SMN2POLBLMNA | |
| Aes-103 SCHEMBL29399464 | 0.82 | ALDH1A1 (0.96) | ALDH1A1TSHRSMN1; SMN2POLBLMNA |
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-5439932-A | Anticholesterol agents | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1995-08-08 | — | — | US | disclosed |
| US-5306728-A | Substituted amine derivatives having antihyperlipemia activity | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1994-04-26 | — | — | US | disclosed |
| EP-0448078-A2 | Substituted amine derivatives having anti-hyperlipemia activity | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1991-09-25 | — | — | EP | disclosed |