Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | PLAU | P00749 | 1/20 | 0.32 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | SRD5A2 | P31213 | 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 | |
|---|---|---|---|---|
| SCHEMBL5800435 | 0.93 | MAOB (0.35) | ABCB11AKR1C3AKR1C2PTGS2SLC22A12 | |
| SCHEMBL5799149 | 0.88 | AKR1C3 (0.43) | ABCB11AKR1C3AKR1C2PTGS2PTGS1 | |
| SCHEMBL5561193 | 0.87 | HPGD (0.34) | HPGDAKR1C3AKR1C2PTGS2TSHR | |
| SCHEMBL5814619 | 0.86 | CNR1 (0.38) | ABCB11AKR1C3AKR1C2PTGS2HSD11B1 | |
| SCHEMBL5559110 | 0.81 | MAOB (0.35) | AKR1C3AKR1C2PTGS2SLC22A12PTGS1 | |
| SCHEMBL5560264 | 0.81 | PTGS2 (0.35) | ABCB11HPGDAKR1C3AKR1C2PTGS2 | |
| SCHEMBL5554202 | 0.81 | TACR3 (0.33) | AKR1C3AKR1C2PTGS2PTGS1 | |
| SCHEMBL5554445 | 0.80 | PPARG (0.37) | AKR1C3AKR1C2HSD11B1 | |
| SCHEMBL6025591 | 0.79 | PTGS2 (0.48) | ABCB11HPGDAKR1C3AKR1C2PTGS2 | |
| SCHEMBL5556113 | 0.79 | AKR1C3 (0.53) | ABCB11AKR1C3AKR1C2PTGS2TSHR |
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-2006050120-A2 | SYNTHESIS OF COX-2 AND FAAH INHIBITORS | MICROBIA, INC. (US) | 2006-05-11 | — | — | WO | disclosed |