Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | NOS2 | P35228 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL32679600 | 0.80 | CES2 (0.50) | ALDH1A1HTTMEN1KMT2AHPGD | |
| SCHEMBL27431294 | 0.77 | L3MBTL1 (0.60) | ALDH1A1KDM4EHTTPKMLMNA | |
| SCHEMBL18421001 | 0.77 | L3MBTL1 (0.49) | ALDH1A1KDM4EHTTPKMLMNA | |
| SCHEMBL1060677 | 0.77 | PTPN1 (0.47) | ALDH1A1HTTPKMKMT2ANPSR1 | |
| SCHEMBL10884733 | 0.76 | CES2 (0.50) | ALDH1A1KDM4EHTTPKMMEN1 | |
| SCHEMBL698882 | 0.75 | ADRA2C (0.64) | ALDH1A1HTTMEN1KMT2ATSHR | |
| SCHEMBL23610332 | 0.75 | KMT2A (0.65) | ALDH1A1KDM4EHTTPKMMEN1 | |
| SCHEMBL11328573 | 0.75 | HTT (0.51) | ALDH1A1KDM4EHTTPKMKMT2A | |
| Hydrochloric Acid SCHEMBL11687905 | 0.73 | L3MBTL1 (0.49) | ALDH1A1KDM4EHTTPKMKMT2A | |
| Hydrochloric Acid SCHEMBL28901385 | 0.73 | HTT (0.50) | ALDH1A1KDM4EHTTPKMKMT2A |
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-4757066-A | Reduces renal toxicity | SANKYO COMPANY LIMITED (JP) | 1988-07-12 | — | — | US | disclosed |