Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.72 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.67 |
| ▸ | POLB | P06746 | 2/20 | 0.63 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | FDPS | P14324 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29953203 | 0.95 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2POLBHPGDKDM4E | |
| SCHEMBL2553344 | 0.84 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2POLBHPGDKDM4E | |
| SCHEMBL15330945 | 0.84 | MAPT (0.64) | ALDH1A1SMN1; SMN2POLBHPGDKDM4E | |
| SCHEMBL29952641 | 0.84 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2POLBHPGDKDM4E | |
| SCHEMBL29952871 | 0.83 | ALDH1A1 (0.70) | ALDH1A1SMN1; SMN2POLBHPGDKDM4E | |
| SCHEMBL15331508 | 0.81 | ALDH1A1 (0.81) | ALDH1A1SMN1; SMN2POLBHPGDKDM4E | |
| SCHEMBL29955935 | 0.81 | NPC1 (0.72) | ALDH1A1SMN1; SMN2POLBHPGDKDM4E | |
| SCHEMBL2552984 | 0.81 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2POLBHPGDKDM4E | |
| SCHEMBL2562037 | 0.81 | ALDH1A1 (0.75) | ALDH1A1SMN1; SMN2POLBHPGDKDM4E | |
| SCHEMBL29953109 | 0.81 | ALDH1A1 (0.75) | ALDH1A1SMN1; SMN2POLBHPGDKDM4E |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |