Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.32 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10041970 | 0.75 | NAPRT (0.41) | SRD5A1KDM4ESLC18A3LMNAMAPT | |
| SCHEMBL9518144 | 0.75 | TRPA1 (0.44) | GRIN2BSRD5A1KDM4ESLC18A3SIGMAR1 | |
| SCHEMBL7975812 | 0.71 | SRD5A1 (0.37) | SRD5A1KDM4ESLC18A3SIGMAR1GAA | |
| SCHEMBL6740701 | 0.68 | SLC18A3 (0.41) | GRIN2BSRD5A1SLC18A3SIGMAR1LMNA | |
| SCHEMBL9876026 | 0.68 | SRD5A1 (0.43) | GRIN2BSRD5A1ALDH1A1SLC18A3SIGMAR1 | |
| SCHEMBL24105190 | 0.68 | SLC18A3 (0.41) | GRIN2BSRD5A1KDM4ESLC18A3SIGMAR1 | |
| SCHEMBL17440328 | 0.68 | SLC18A3 (0.41) | GRIN2BSRD5A1KDM4ESLC18A3SIGMAR1 | |
| SCHEMBL17440329 | 0.68 | SLC18A3 (0.41) | GRIN2BSRD5A1KDM4ESLC18A3SIGMAR1 | |
| SCHEMBL25073357 | 0.68 | SLC18A3 (0.41) | GRIN2BSRD5A1KDM4ESLC18A3SIGMAR1 | |
| SCHEMBL9372709 | 0.68 | GAA (0.41) | GRIN2BSRD5A1KDM4ESLC18A3SIGMAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6914160-B1 | Oxytocin inhibitors | PFIZER INC (US) | 2005-07-05 | — | — | US | disclosed |
| EP-1537085-A1 | OXYTOCIN INHIBITORS | Pfizer Limited (GB) | 2005-06-08 | — | — | EP | disclosed |
| WO-2004020414-A1 | OXYTOCIN INHIBITORS | PFIZER LIMITED (GB) | 2004-03-11 | — | — | WO | disclosed |
| WO-2000002864-A1 | PRECUSORS FOR PNA-MONOMERS | MARTENS JUERGEN (DE) | 2000-01-20 | — | — | WO | disclosed |