Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | LTA4H | P09960 | 1/20 | 0.32 |
| ▸ | GNAI3 | P08754 | 2/20 | 0.32 |
| ▸ | GNAO1 | P09471 | 2/20 | 0.32 |
| ▸ | GNAI1 | P63096 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12912378 | 0.88 | CYP2D6 (0.48) | CYP2D6CYP2C19GRIN1GRIN2BLTA4H | |
| SCHEMBL27097500 | 0.88 | KDM4E (0.38) | HRH3KDM4ELMNAGNAI3GNAO1 | |
| SCHEMBL12912029 | 0.84 | GNAI3 (0.42) | GNAI3GNAO1GNAI1 | |
| SCHEMBL14749186 | 0.84 | GNAI3 (0.42) | GNAI3GNAO1GNAI1 | |
| SCHEMBL14749169 | 0.84 | GNAI3 (0.42) | GNAI3GNAO1GNAI1 | |
| SCHEMBL15685442 | 0.83 | DRD2 (0.41) | HRH3 | |
| SCHEMBL10152381 | 0.83 | DRD2 (0.41) | HRH3 | |
| SCHEMBL15133969 | 0.83 | DRD2 (0.41) | HRH3 | |
| SCHEMBL12911942 | 0.82 | GNAO1 (0.49) | GNAI3GNAO1GNAI1 | |
| SCHEMBL13193523 | 0.82 | GBA1 (0.39) | CYP2D6CYP2C19ALDH1A1GRIN1GRIN2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024055112-A1 | BIFUNCTIONAL COMPOUNDS AND PHARMACEUTICAL USES THEREOF | Risen (Suzhou) Pharma Tech Co., Ltd. (CN) | 2024-03-21 | — | — | WO | disclosed |
| WO-2023205892-A1 | CDK INHIBITORS AND PHARMACEUTICAL USES THEREOF | Risen (Suzhou) Pharma Tech Co., Ltd. (CN) | 2023-11-02 | — | — | WO | disclosed |