Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 6/20 | 0.78 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.78 |
| ▸ | PTGS2 | P35354 | 11/20 | 0.65 |
| ▸ | CNR2 | P34972 | 1/20 | 0.65 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.64 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL13448804 | 0.92 | AKR1C3 (0.83) | AKR1C3AKR1C2PTGS2CNR2MAPT | |
| SCHEMBL20259423 | 0.91 | PTGS2 (0.78) | AKR1C3AKR1C2PTGS2CNR2PTGS1 | |
| SCHEMBL16656482 | 0.87 | AKR1C3 (1.00) | AKR1C3AKR1C2PTGS2CNR2PTGS1 | |
| SCHEMBL15062608 | 0.87 | AKR1C3 (0.69) | AKR1C3AKR1C2PTGS2CNR2PTGS1 | |
| SCHEMBL4055730 | 0.87 | PTGS1 (0.82) | AKR1C3AKR1C2PTGS2PTGS1MAPT | |
| SCHEMBL25873193 | 0.85 | PTGS2 (0.80) | AKR1C3AKR1C2PTGS2CNR2PTGS1 | |
| SCHEMBL13195816 | 0.80 | PTGS2 (0.74) | AKR1C3AKR1C2PTGS2CNR2PTGS1 | |
| SCHEMBL17369559 | 0.79 | PTGS2 (0.73) | AKR1C3AKR1C2PTGS2CNR2PTGS1 | |
| SCHEMBL30761037 | 0.79 | AKR1C3 (0.87) | AKR1C3AKR1C2PTGS2CNR2PTGS1 | |
| SCHEMBL30426824 | 0.79 | PTGS2 (1.00) | AKR1C3AKR1C2PTGS2CNR2PTGS1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102850324-A | Indole compounds | MICROBIA INC | 2013-01-02 | — | — | CN | disclosed |
| CN-101563337-A | Indole compounds | MICROBIA INC (US) | 2009-10-21 | — | — | CN | disclosed |