Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CSF1R | P07333 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL23966639 | 0.83 | MEN1 (0.37) | HRH4CSF1RKMT2A | |
| SCHEMBL25799458 | 0.81 | SMN1; SMN2 (0.34) | ALDH1A1HRH4TSHRKMT2A | |
| SCHEMBL427051 | 0.69 | ALDH1A1 (0.43) | ALDH1A1KDM4ETRPM8 | |
| SCHEMBL20234660 | 0.68 | ALDH1A1 (0.47) | ALDH1A1KDM4EHRH4CYP1A2CYP2C9 | |
| SCHEMBL10104245 | 0.66 | TRPM8 (0.38) | ALDH1A1KDM4ETSHRMAPK1KMT2A | |
| SCHEMBL20320491 | 0.66 | TRPM8 (0.38) | ALDH1A1KDM4ECYP1A2TSHRTRPM8 | |
| SCHEMBL1089518 | 0.66 | TRPM8 (0.38) | ALDH1A1KDM4ETSHRKMT2ATRPM8 | |
| SCHEMBL13559779 | 0.66 | AURKA (0.53) | ALDH1A1KDM4E | |
| SCHEMBL19599660 | 0.64 | KDM4E (0.51) | ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL27360043 | 0.64 | SMN1; SMN2 (0.41) | ALDH1A1HRH4POLB |
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-2021252488-A1 | INHIBITORS OF NEK7 KINASE | Halia Therapeutics, Inc. (US) | 2021-12-16 | — | — | WO | disclosed |
| WO-2021242505-A1 | INHIBITORS OF NEK7 KINASE | Halia Therapeutics, Inc. (US) | 2021-12-02 | — | — | WO | disclosed |