Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.37 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.37 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.37 |
| ▸ | LSS | P48449 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 7/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | SPHK2 | Q9NRA0 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL21988093 | 0.93 | CYP1A2 (0.48) | CYP1A2HTTLMNAMAPK1EPHX1 | |
| SCHEMBL3681808 | 0.88 | CYP1A2 (0.48) | CYP1A2HTTLMNAMAPK1EPHX1 | |
| SCHEMBL2159790 | 0.86 | CYP1A2 (0.50) | CYP1A2HTTLMNAMAPK1EPHX1 | |
| SCHEMBL17592459 | 0.86 | CYP1A2 (0.50) | CYP1A2HTTLMNAMAPK1EPHX1 | |
| SCHEMBL2159788 | 0.86 | CYP1A2 (0.50) | CYP1A2HTTLMNAMAPK1EPHX1 | |
| SCHEMBL3682782 | 0.86 | CYP1A2 (0.47) | CYP1A2EPHX1GNAI3GNAO1GNAI1 | |
| SCHEMBL3687668 | 0.86 | CYP1A2 (0.47) | CYP1A2EPHX1GNAI3GNAO1GNAI1 | |
| SCHEMBL3677758 | 0.86 | CYP1A2 (0.47) | CYP1A2EPHX1GNAI3GNAO1GNAI1 | |
| SCHEMBL3680465 | 0.86 | CYP1A2 (0.47) | CYP1A2EPHX1GNAI3GNAO1GNAI1 | |
| SCHEMBL3682324 | 0.86 | CYP1A2 (0.47) | CYP1A2EPHX1GNAI3GNAO1GNAI1 |
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-2023092107-A1 | CDK2 INHIBITORS AND METHODS OF MAKING AND USING SAME | BLUEPRINT MEDICINES CORPORATION (US) | 2023-05-25 | — | — | WO | disclosed |