Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | CCR1 | P32246 | 1/20 | 0.42 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
| ▸ | CCR8 | P51685 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.37 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.37 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6619720 | 0.88 | ALDH1A1 (0.57) | ALDH1A1LMNACCR1CCR5CCR8 | |
| Isopropyl Alcohol SCHEMBL6839921 | 0.83 | ALDH1A1 (0.50) | ALDH1A1LMNACCR1CCR5CCR8 | |
| SCHEMBL13040670 | 0.77 | ALDH1A1 (0.35) | ALDH1A1LMNAMAPTRECQLKDM4E | |
| SCHEMBL4593796 | 0.76 | RECQL (0.47) | ALDH1A1LMNAMAPTRECQLKDM4E | |
| SCHEMBL4648753 | 0.69 | ALDH1A1 (0.39) | ALDH1A1LMNACCR1CCR5CCR8 | |
| SCHEMBL3560036 | 0.69 | KDM4E (0.47) | ALDH1A1LMNACCR1CCR5CCR8 | |
| SCHEMBL18585998 | 0.69 | ALDH1A1 (0.36) | ALDH1A1LMNACCR1CCR5CCR8 | |
| SCHEMBL2562409 | 0.69 | ALDH1A1 (0.40) | ALDH1A1LMNACCR1CCR5CCR8 | |
| SCHEMBL7211888 | 0.68 | PTGS2 (0.59) | ALDH1A1LMNAMAPTHPGDKDM4E | |
| SCHEMBL13040657 | 0.68 | ALDH1A1 (0.36) | ALDH1A1LMNACCR1CCR5CCR8 |
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-6727239-B1 | INHIBITORY ACTIVITY ON NO- SYNTHASE ENZYMES PRODUCING NITROGEN MONOXIDE NO AND/OR AN ACTIVITY WHICH TRAPS THE REACTIVE OXYGEN SPECIES (ROS) | SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) | 2004-04-27 | — | — | US | disclosed |