Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.37 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.33 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL26997364 | 0.84 | CYP11B2 (0.34) | PDE1CCYP11B2HTR2AHTR2CHTR2B | |
| SCHEMBL25696305 | 0.79 | KMO (0.45) | KMOCYP11B1CYP11B2CYP1A2MEN1 | |
| SCHEMBL25702756 | 0.78 | CYP1A2 (0.36) | KMOCYP1A2MEN1ALDH1A1CYP3A4 | |
| SCHEMBL20117304 | 0.73 | KMO (0.48) | KMOCHRM2CHRM1CYP1A2ALDH1A1 | |
| SCHEMBL425168 | 0.70 | KMO (0.57) | KMOPDE1CCYP11B2CYP1A2HTR2A | |
| SCHEMBL29901474 | 0.70 | KMO (0.57) | KMOPDE1CCYP11B2CYP1A2HTR2A | |
| SCHEMBL13607536 | 0.70 | KMO (0.61) | KMOCHRM2CHRM1CHRM3PDE1C | |
| SCHEMBL20676291 | 0.69 | KMO (0.43) | KMOCHRM2CHRM1CHRM3PDE1C | |
| SCHEMBL91363 | 0.68 | KMO (0.58) | KMOCHRM2CHRM1CHRM3MEN1 | |
| SCHEMBL5020883 | 0.67 | RET (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019209948-A9 | COMPOUNDS AND USES THEREOF | YUMANITY THERAPEUTICS, INC. (US) | 2020-01-02 | — | — | WO | disclosed |
| WO-2019018795-A1 | COMPOUNDS AND USES THEREOF | YUMANITY THERAPEUTICS (US) | 2019-01-24 | — | — | WO | disclosed |
| WO-2018081167-A1 | COMPOUNDS AND USES THEREOF | YUMANITY THERAPEUTICS (US) | 2018-05-03 | — | — | WO | disclosed |