Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KLK7 | P49862 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.33 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.33 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.33 |
| ▸ | SCN1A | P35498 | 1/20 | 0.33 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.33 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL19286233 | 1.00 | TSHR (0.38) | TSHRMAPTHTTRECQLSLC18A3 | |
| SCHEMBL16316097 | 1.00 | TSHR (0.38) | TSHRMAPTHTTRECQLSLC18A3 | |
| SCHEMBL25159570 | 1.00 | TSHR (0.38) | TSHRMAPTHTTRECQLSLC18A3 | |
| SCHEMBL25159725 | 1.00 | TSHR (0.38) | TSHRMAPTHTTRECQLSLC18A3 | |
| SCHEMBL16549232 | 0.83 | CHRNB4 (0.36) | — | |
| SCHEMBL17470033 | 0.78 | HIF1A (0.37) | RECQLLMNACYP1A2CYP2D6 | |
| SCHEMBL19286298 | 0.78 | HIF1A (0.37) | RECQLLMNACYP1A2CYP2D6 | |
| SCHEMBL13150731 | 0.78 | KCNA5 (0.33) | RECQLALDH1A1KMT2AMEN1LMNA | |
| SCHEMBL19619102 | 0.77 | ALDH1A1 (0.33) | RECQLALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL19832490 | 0.77 | ALDH1A1 (0.33) | RECQLALDH1A1CYP1A2CYP2D6 |
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-9744528-B2 | Metallorganocatalysis for asymmetric transformations | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2017-08-29 | — | — | US | disclosed |