Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ORAI1 | Q96D31 | 2/20 | 0.49 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.42 |
| ▸ | ABL1 | P00519 | 2/20 | 0.38 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | PLG | P00747 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1459926 | 0.85 | ORAI1 (0.55) | ORAI1CYP1A1LOXL2ABL1AAK1 | |
| SCHEMBL1459545 | 0.85 | ORAI1 (0.47) | ORAI1CYP1A1LOXL2ABL1MAPT | |
| SCHEMBL1458826 | 0.83 | ORAI1 (0.66) | ORAI1CYP1A1LOXL2ABL1AAK1 | |
| SCHEMBL12825457 | 0.80 | LOXL2 (0.46) | ORAI1CYP1A1LOXL2ABL1AAK1 | |
| SCHEMBL1460119 | 0.79 | ORAI1 (0.77) | ORAI1CYP1A1LOXL2ABL1AAK1 | |
| SCHEMBL1459598 | 0.78 | CYP11B1 (0.51) | ORAI1LOXL2ABL1MAPT | |
| SCHEMBL1459224 | 0.73 | CYP19A1 (0.42) | ORAI1LOXL2ABL1 | |
| SCHEMBL12826642 | 0.72 | ALOX5AP (0.36) | ORAI1ABL1KLKB1 | |
| SCHEMBL12825539 | 0.72 | ALOX5AP (0.36) | ORAI1ABL1KLKB1 | |
| SCHEMBL15751035 | 0.72 | ORAI1 (0.73) | ORAI1ABL1MAPTRAB9ANPC1 |
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-2011036130-A1 | INDOLE DERIVATIVES AS CRAC MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-03-31 | — | — | WO | disclosed |