Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 3/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.51 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.51 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL27299325 | 0.87 | ALDH1A1 (0.71) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7009713 | 0.86 | MEN1 (0.58) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7009709 | 0.86 | MEN1 (0.58) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7694701 | 0.84 | ALDH1A1 (0.64) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7694702 | 0.84 | ALDH1A1 (0.64) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7689571 | 0.83 | ALDH1A1 (0.63) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9330103 | 0.82 | ALDH1A1 (0.69) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL8671546 | 0.81 | KCNH2 (0.51) | ALDH1A1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6621881 | 0.81 | CA12 (0.47) | ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL19212464 | 0.81 | CA12 (0.47) | ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19 |
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-2002000622-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-01-03 | — | — | WO | disclosed |