Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MASP2 | O00187 | 1/20 | 0.35 |
| ▸ | PLAU | P00749 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 2/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | SNCA | P37840 | 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 | |
|---|---|---|---|---|
| SCHEMBL24934027 | 0.79 | CYP3A4 (0.37) | POLBCYP3A4HPGDMAPK1 | |
| SCHEMBL14896662 | 0.77 | MASP2 (0.39) | MASP2PLAUTHPOAPEX1F2 | |
| SCHEMBL22171329 | 0.72 | MASP2 (0.35) | MASP2PLAUTHPOAPEX1F2 | |
| SCHEMBL22174797 | 0.72 | CYP19A1 (0.38) | MASP2PLAUTHPOAPEX1F2 | |
| SCHEMBL24213539 | 0.71 | PLAU (0.44) | MASP2PLAUTHPOAPEX1F2 | |
| SCHEMBL18519532 | 0.71 | MASP2 (0.34) | MASP2PLAUTHPOAPEX1F2 | |
| SCHEMBL18830431 | 0.69 | ADRB2 (0.34) | MASP2PLAUTHPOAPEX1F2 | |
| SCHEMBL25048804 | 0.65 | KMO (0.46) | MEN1POLBKMT2A | |
| SCHEMBL22179262 | 0.65 | MAPT (0.37) | LMNACYP3A4MAPTSMN1; SMN2PARP10 | |
| SCHEMBL14896712 | 0.64 | ADRB2 (0.36) | THPOAPEX1MEN1LMNAPOLB |
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-2023009475-A1 | ROCK2 INHIBITORS AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-02-02 | — | — | WO | disclosed |