Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.70 |
| ▸ | GRM5 | P41594 | 5/20 | 0.66 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | CTSA | P10619 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | FPR2 | P25090 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL18157932 | 0.86 | P2RX7 (0.72) | P2RX7GRM5RAB9ACTSAHPGD | |
| SCHEMBL4454044 | 0.85 | HDAC8 (0.59) | P2RX7HDAC8RAB9APOLBNPC1 | |
| SCHEMBL8300009 | 0.84 | P2RX7 (0.70) | P2RX7GRM5RAB9ACTSAHPGD | |
| Hydrochloric Acid SCHEMBL5866071 | 0.83 | HDAC8 (0.57) | P2RX7HDAC8RAB9APOLBNPC1 | |
| SCHEMBL314520 | 0.82 | P2RX7 (1.00) | P2RX7GRM5RAB9ACTSAHPGD | |
| SCHEMBL3860067 | 0.79 | GRM5 (1.00) | P2RX7GRM5RAB9AHPGDPOLB | |
| SCHEMBL31121627 | 0.79 | P2RX7 (0.64) | P2RX7GRM5RAB9ACTSAHPGD | |
| SCHEMBL12163955 | 0.79 | P2RX7 (0.69) | P2RX7GRM5RAB9ACTSAHPGD | |
| SCHEMBL2237588 | 0.79 | P2RX7 (0.62) | P2RX7GRM5RAB9ACTSAHPGD | |
| SCHEMBL1958309 | 0.79 | P2RX7 (0.62) | P2RX7GRM5RAB9ACTSANPC1 |
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-2024050433-A1 | ALLOSTERIC MODULATORS OF ANDROGEN RECEPTOR COACTIVATOR RECRUITMENT FOR CRPC THERAPY | UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2024-03-07 | — | — | WO | disclosed |