Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13213274 | 0.83 | ALOX15 (0.44) | ALOX15ALOX12TSHRSMN1; SMN2POLB | |
| SCHEMBL21708939 | 0.81 | ALOX15 (0.39) | ALOX15ALOX12TSHRSMN1; SMN2POLB | |
| SCHEMBL21708925 | 0.79 | ACHE (0.33) | ACHETSHR | |
| SCHEMBL21708907 | 0.78 | ALOX15 (0.41) | ALOX15ALOX12TSHRSMN1; SMN2NPC1 | |
| SCHEMBL30614477 | 0.78 | POLB (0.56) | POLBMEN1KMT2ALMNA | |
| SCHEMBL21708859 | 0.75 | CA12 (0.43) | ALOX15ALOX12ACHETSHRPYCR1 | |
| SCHEMBL21709146 | 0.75 | TSHR (0.36) | TSHR | |
| SCHEMBL5187832 | 0.75 | CYP1A2 (0.53) | ALOX15ALOX12CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9589157 | 0.74 | ALOX15 (0.50) | ALOX15ALOX12TSHRSMN1; SMN2NPC1 | |
| SCHEMBL11888425 | 0.73 | TAAR1 (0.53) | ALOX15ALOX12TSHRCYP1A2KIF11 |
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-2020032080-A1 | COMPOUND, SALT OF COMPOUND, NEUROMODULATION AGENT, METHOD FOR EVALUATING NEUROMODULATION AGENT, METHOD FOR PRODUCING COMPOUND, AND METHOD FOR PRODUCING SALT OF COMPOUND | 学校法人慶應義塾 | 2020-02-13 | — | — | WO | disclosed |