Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.71 |
| ▸ | MEN1 | O00255 | 1/20 | 0.71 |
| ▸ | MAPT | P10636 | 5/20 | 0.62 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 4/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA4 | P22748 | 1/20 | 0.53 |
| ▸ | CA6 | P23280 | 1/20 | 0.53 |
| ▸ | CA7 | P43166 | 1/20 | 0.53 |
| ▸ | TPMT | P51580 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL30163184 | 1.00 | KMT2A (0.71) | KMT2AMEN1MAPTPOLBSMN1; SMN2 | |
| SCHEMBL16544890 | 0.88 | MAPT (0.62) | KMT2AMEN1MAPTSMN1; SMN2TSHR | |
| SCHEMBL9774170 | 0.87 | KMT2A (0.75) | KMT2AMEN1POLBSMN1; SMN2TSHR | |
| SCHEMBL21307088 | 0.86 | MAPT (0.65) | KMT2AMEN1MAPTSMN1; SMN2TSHR | |
| SCHEMBL5907838 | 0.86 | KMT2A (0.73) | KMT2AMEN1POLBSMN1; SMN2TSHR | |
| SCHEMBL14430174 | 0.85 | MAPT (0.68) | KMT2AMEN1MAPTSMN1; SMN2TSHR | |
| SCHEMBL642934 | 0.85 | MAPT (0.59) | KMT2AMEN1MAPTSMN1; SMN2TSHR | |
| SCHEMBL1495947 | 0.84 | MEN1 (0.51) | KMT2AMEN1MAPTPOLBSMN1; SMN2 | |
| SCHEMBL1015707 | 0.84 | TSHR (0.73) | KMT2AMEN1MAPTSMN1; SMN2TSHR | |
| SCHEMBL19422126 | 0.84 | MAPT (0.66) | KMT2AMEN1MAPTSMN1; SMN2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-118055926-A | ROCK2 inhibitors and uses thereof | 哈佛大学的校长及成员们 | 2024-05-17 | — | — | CN | disclosed |
| WO-2023009475-A1 | ROCK2 INHIBITORS AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-02-02 | — | — | WO | disclosed |