Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | MGLL | Q99685 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MDH1 | P40925 | 1/20 | 0.44 |
| ▸ | MDH2 | P40926 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30163055 | 1.00 | MAPT (0.55) | MAPTKMT2ASMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL15542418 | 0.88 | KMT2A (0.67) | KMT2ASMN1; SMN2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL24933573 | 0.88 | TSHR (0.62) | KMT2ATSHRMEN1MAPK1MTNR1A | |
| SCHEMBL24933575 | 0.86 | KMT2A (0.52) | MAPTKMT2ASMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL1495913 | 0.86 | MAPT (0.47) | MAPTKMT2ACYP1A2CYP2C9TSHR | |
| SCHEMBL6581250 | 0.85 | LMNA (0.42) | MAPTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1929602 | 0.85 | LMNA (0.48) | MAPTKMT2ASMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL8836080 | 0.84 | KMT2A (0.53) | MAPTKMT2ASMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL24933567 | 0.83 | SMN1; SMN2 (0.53) | MAPTKMT2ASMN1; SMN2TSHRMEN1 | |
| SCHEMBL13665111 | 0.82 | NPC1 (0.50) | MAPTKMT2ASMN1; SMN2CYP1A2CYP3A4 |
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 |