Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 10/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | SLC22A6 | Q4U2R8 | 2/20 | 0.50 |
| ▸ | CDC42 | P60953 | 1/20 | 0.50 |
| ▸ | RAC1 | P63000 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.47 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.47 |
| ▸ | ALB | P02768 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | RARB | P10826 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10881708 | 0.98 | PTGS2 (0.52) | PTGS2PTGS1AKR1C3AKR1C2TSHR | |
| SCHEMBL27738099 | 0.85 | ALOX15 (0.49) | LMNAALOX15GFERADAM17ATM | |
| SCHEMBL11460737 | 0.85 | AKR1C3 (0.71) | PTGS2PTGS1AKR1C3AKR1C2TSHR | |
| SCHEMBL27579668 | 0.83 | KMT2A (0.60) | PTGS2PTGS1AKR1C3AKR1C2TSHR | |
| SCHEMBL3668959 | 0.83 | PTGS1 (0.69) | PTGS2PTGS1AKR1C3AKR1C2TSHR | |
| SCHEMBL11537341 | 0.82 | AKR1C3 (0.68) | PTGS2PTGS1AKR1C3AKR1C2TSHR | |
| SCHEMBL8455312 | 0.81 | AKR1C3 (0.55) | AKR1C3AKR1C2CYP1A2LMNACYP2C9 | |
| SCHEMBL3681215 | 0.81 | AKR1C3 (0.55) | AKR1C3AKR1C2CYP1A2LMNACYP2C9 | |
| SCHEMBL11014337 | 0.81 | ALOX15 (0.49) | PTGS2PTGS1LMNAALOX15GFER | |
| SCHEMBL3424037 | 0.81 | AKR1C3 (0.55) | AKR1C3AKR1C2CYP1A2LMNACYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108602760-A | Indane derivatives as MG L UR7 modulators | 武田药品工业株式会社 | 2018-09-28 | — | — | CN | disclosed |