Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.39 |
| ▸ | TUBB | P07437 | 1/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.39 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.39 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.39 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.39 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.39 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.39 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.39 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.39 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13575041 | 0.81 | ALDH1A1 (0.44) | ALDH1A1KDM4EMAPTCYP1A2CYP2C19 | |
| SCHEMBL29953280 | 0.81 | ERN1 (0.51) | ALDH1A1KDM4EMAPTCYP1A2CYP2C19 | |
| SCHEMBL1612856 | 0.81 | ERN1 (0.51) | ALDH1A1KDM4EMAPTCYP1A2CYP2C19 | |
| SCHEMBL29953515 | 0.81 | ERN1 (0.51) | ALDH1A1KDM4EMAPTCYP1A2CYP2C19 | |
| SCHEMBL31077727 | 0.79 | ALDH1A1 (0.43) | ALDH1A1MAPTTUBB4ATUBBTUBA3C | |
| SCHEMBL17958314 | 0.78 | ERN1 (0.44) | ALDH1A1KDM4EMAPTCYP1A2CYP2C19 | |
| SCHEMBL29957097 | 0.78 | ERN1 (0.44) | ALDH1A1KDM4EMAPTCYP1A2CYP2C19 | |
| SCHEMBL29953083 | 0.76 | CYP2A6 (0.44) | ALDH1A1KDM4EMAPTCYP1A2CYP2C19 | |
| SCHEMBL29951496 | 0.76 | CYP2A6 (0.56) | ALDH1A1KDM4EMAPTCYP1A2CYP2C19 | |
| SCHEMBL29953426 | 0.76 | HTR1A (0.47) | ALDH1A1KDM4EMAPTCYP1A2CYP2C19 |
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 |