Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CCR6 | P51684 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20835402 | 0.82 | ALDH1A1 (0.45) | ALDH1A1TDP1RIPK1KCNH2SCN3A | |
| SCHEMBL21094403 | 0.79 | ALDH1A1 (0.45) | ALDH1A1TDP1RIPK1KCNH2SCN3A | |
| SCHEMBL22451403 | 0.78 | RIPK1 (0.36) | ALDH1A1TP53RIPK1KCNH2SCN3A | |
| SCHEMBL19803647 | 0.78 | RIPK1 (0.36) | ALDH1A1TP53RIPK1KCNH2SCN3A | |
| SCHEMBL20843455 | 0.78 | RIPK1 (0.36) | ALDH1A1TP53RIPK1KCNH2SCN3A | |
| SCHEMBL24220439 | 0.74 | KCNH2 (0.49) | ALDH1A1MAPTTDP1KCNH2SCN3A | |
| SCHEMBL20835748 | 0.74 | KCNH2 (0.49) | ALDH1A1MAPTTDP1KCNH2SCN3A | |
| SCHEMBL20835688 | 0.74 | RIPK1 (0.41) | ALDH1A1KMT2AMEN1TDP1RIPK1 | |
| SCHEMBL22451655 | 0.73 | RIPK1 (0.41) | TDP1RIPK1KCNH2SCN3A | |
| SCHEMBL20843428 | 0.73 | RIPK1 (0.41) | TDP1RIPK1KCNH2SCN3A |
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-2019112024-A1 | PYRROLIDINE COMPOUND | キッセイ薬品工業株式会社 | 2019-06-13 | — | — | WO | disclosed |