Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.47 |
| ▸ | SSTR4 | P31391 | 3/20 | 0.44 |
| ▸ | SSTR1 | P30872 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | RXRB | P28702 | 1/20 | 0.43 |
| ▸ | RXRG | P48443 | 1/20 | 0.43 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | XBP1 | P17861 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17420564 | 0.85 | SMN1; SMN2 (0.41) | S1PR1SSTR4SSTR1MEN1GAA | |
| SCHEMBL8089358 | 0.83 | RXRA (0.49) | S1PR1SSTR4SSTR1MEN1GAA | |
| SCHEMBL21539533 | 0.82 | ATM (0.48) | MEN1GAAKMT2ALMNASMN1; SMN2 | |
| SCHEMBL21748706 | 0.82 | SSTR4 (0.58) | S1PR1SSTR4SSTR1MEN1GAA | |
| SCHEMBL30087620 | 0.81 | RXRA (0.44) | S1PR1SSTR4SSTR1CYP1A2CYP2C9 | |
| SCHEMBL28060228 | 0.76 | RXRA (0.50) | S1PR1SSTR4SSTR1MEN1GAA | |
| SCHEMBL19768706 | 0.75 | HSD17B10 (0.49) | SSTR4SSTR1CYP1A2MEN1GAA | |
| SCHEMBL10499645 | 0.75 | SLC6A3 (0.54) | S1PR1CYP1A2CYP2C9MEN1GAA | |
| SCHEMBL10030744 | 0.75 | AR (0.51) | S1PR1CYP1A2CYP2C9MEN1GAA | |
| SCHEMBL21539728 | 0.74 | RXRA (0.36) | SSTR4SSTR1RXRARXRBRXRG |
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 |
|---|---|---|---|---|---|---|---|
| US-6090805-A | Tocolytic oxytocin receptor antagonists | MERCK & CO., INC. (US) | 2000-07-18 | — | — | US | disclosed |