Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 2/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | PTGES | O14684 | 1/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17486279 | 1.00 | CYP11B2 (0.37) | CYP11B2CHEK1CYP11B1HTTKMT2A | |
| SCHEMBL24179476 | 0.78 | CYP11B2 (0.33) | CYP11B2ALDH1A1NPSR1TDP1 | |
| SCHEMBL21927523 | 0.77 | HTT (0.42) | CYP11B2CYP11B1HTTALDH1A1NPSR1 | |
| SCHEMBL322329 | 0.75 | HTT (0.54) | CYP11B2CHEK1CYP11B1HTTKMT2A | |
| SCHEMBL31200432 | 0.75 | CHRNB2 (0.40) | CYP11B2CHEK1CYP11B1HTTKMT2A | |
| SCHEMBL29904603 | 0.75 | ALDH1A1 (0.53) | CYP11B2CHEK1CYP11B1HTTKMT2A | |
| SCHEMBL1164261 | 0.75 | ALDH1A1 (0.53) | CYP11B2CHEK1CYP11B1HTTKMT2A | |
| SCHEMBL459834 | 0.75 | CHEK1 (0.37) | CYP11B2CHEK1CYP11B1HTTKMT2A | |
| SCHEMBL30259596 | 0.75 | CYP11B2 (0.44) | CYP11B2CHEK1CYP11B1HTTKMT2A | |
| SCHEMBL30217691 | 0.75 | HTT (0.54) | CYP11B2CHEK1CYP11B1HTTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3972963-A1 | IDENTIFICATION AND USE OF KRAS INHIBITORS | Bayer Aktiengesellschaft (DE) | 2022-03-30 | — | — | EP | disclosed |