Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | GRM5 | P41594 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | THPO | P40225 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.49 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3716091 | 0.84 | GRM5 (0.53) | ALDH1A1GRM5NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL22939878 | 0.83 | ALDH1A1 (0.46) | ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL1202115 | 0.79 | GRM5 (0.56) | ALDH1A1GRM5NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL22939610 | 0.74 | ALDH1A1 (0.45) | ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL16726594 | 0.74 | ALDH1A1 (0.54) | ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL9944389 | 0.72 | ALDH1A1 (0.59) | ALDH1A1GRM5NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL22940095 | 0.71 | MAPT (0.64) | ALDH1A1GRM5NPC1RAB9AKDM4E | |
| SCHEMBL5788637 | 0.71 | ALDH1A1 (0.57) | ALDH1A1NPC1RAB9AMEN1CYP1A2 | |
| SCHEMBL32668996 | 0.71 | ALDH1A1 (0.61) | ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL29660326 | 0.71 | MAPT (0.64) | ALDH1A1GRM5NPC1RAB9AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021019051-A1 | INHIBITORS OF HUMAN ATGL | Karl-Franzens-Universität Graz (AT) | 2021-02-04 | — | — | WO | disclosed |