Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.46 |
| ▸ | RXRA | P19793 | 1/20 | 0.45 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.43 |
| ▸ | S100A4 | P26447 | 1/20 | 0.42 |
| ▸ | HNF4A | P41235 | 2/20 | 0.41 |
| ▸ | ERN1 | O75460 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2680824 | 1.00 | TSHR (0.59) | TSHRCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL28917008 | 0.81 | TSHR (0.58) | TSHRCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL4888746 | 0.80 | TSHR (0.53) | TSHRCYP3A4ALDH1A1MEN1KMT2A | |
| Ammonia Solution, Strong SCHEMBL27861099 | 0.79 | TSHR (0.55) | TSHRCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL3168642 | 0.78 | MAPT (0.55) | TSHRCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL1595062 | 0.78 | TSHR (0.54) | TSHRCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL3168647 | 0.78 | MAPT (0.55) | TSHRCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL1710123 | 0.78 | TSHR (0.54) | TSHRCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL6884488 | 0.78 | TSHR (0.54) | TSHRCYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL31179441 | 0.77 | HASPIN (0.51) | ERN1 |
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-2024181437-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND HAVING MYT1 INHIBITORY ACTIVITY | 中外製薬株式会社 | 2024-09-06 | — | — | WO | disclosed |
| WO-2024026536-A1 | ANTIVIRAL COMPOUNDS AND USES THEREOF | GRIFFITH UNIVERSITY (AU) | 2024-02-08 | — | — | WO | disclosed |