Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 13/20 | 0.52 |
| ▸ | OXTR | P30559 | 11/20 | 0.52 |
| ▸ | AVPR2 | P30518 | 8/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | BRD2 | P25440 | 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 | |
|---|---|---|---|---|
| SCHEMBL2130122 | 0.82 | AVPR1A (0.74) | AVPR1AOXTRAVPR2CHRM2CHRM4 | |
| SCHEMBL6201929 | 0.76 | BRD4 (0.60) | AVPR1AOXTRAVPR2ALDH1A1LMNA | |
| SCHEMBL5570643 | 0.74 | AVPR1A (0.65) | AVPR1AOXTRAVPR2CHRM2CHRM4 | |
| SCHEMBL2704576 | 0.74 | AVPR1A (0.61) | AVPR1AOXTRAVPR2CHRM2CHRM4 | |
| SCHEMBL18917221 | 0.72 | AVPR1A (0.63) | AVPR1AOXTRAVPR2CHRM2CHRM4 | |
| SCHEMBL2129142 | 0.72 | AVPR1A (0.61) | AVPR1AOXTRAVPR2CHRM2CHRM4 | |
| SCHEMBL5567012 | 0.72 | AVPR1A (0.63) | AVPR1AOXTRAVPR2CHRM2CHRM4 | |
| Hydrochloric Acid SCHEMBL5270039 | 0.72 | AVPR2 (0.56) | AVPR1AOXTRAVPR2 | |
| SCHEMBL18944536 | 0.72 | AVPR1A (0.80) | AVPR1AOXTRAVPR2CHRM2CHRM4 | |
| SCHEMBL9961437 | 0.72 | AVPR1A (0.72) | AVPR1AOXTRAVPR2CHRM2CHRM4 |
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-2018107216-A1 | NON-PEPTIDE OXYTOCIN RECEPTOR AGONISTS | THE UNIVERSITY OF SYDNEY (AU) | 2018-06-21 | — | — | WO | disclosed |