Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.33 |
| ▸ | ESR1 | P03372 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.33 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.33 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | BLM | P54132 | 2/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.33 |
| ▸ | ALB | P02768 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19771973 | 0.81 | NOS3 (0.42) | GABRA1GABRB2TSHRMAPK1AR | |
| SCHEMBL28056405 | 0.79 | PDE2A (0.41) | PTGS2PTGS1LMNAESR1MEN1 | |
| SCHEMBL16792307 | 0.76 | GABRA1 (0.41) | GABRA1GABRB2PTGS2PTGS1LMNA | |
| SCHEMBL10159908 | 0.76 | GABRA1 (0.41) | GABRA1GABRB2PTGS2PTGS1LMNA | |
| SCHEMBL7562470 | 0.76 | GABRA1 (0.50) | GABRA1GABRB2PTGS2PTGS1LMNA | |
| SCHEMBL20875726 | 0.75 | GABRA1 (0.43) | GABRA1GABRB2PTGS2PTGS1LMNA | |
| SCHEMBL21196903 | 0.71 | SKP2 (0.50) | PTGS2PTGS1LMNACYP2C9ESR1 | |
| SCHEMBL8252056 | 0.71 | GABRA1 (0.46) | GABRA1GABRB2SLC6A2SLC6A3 | |
| SCHEMBL3960388 | 0.71 | GABRA1 (0.66) | GABRA1GABRB2PTGS2LMNACYP2C9 | |
| SCHEMBL13963069 | 0.71 | GABRA1 (0.46) | GABRA1GABRB2PTGS2PTGS1LMNA |
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-4075354-A | ETHYNYLBENZENE COMPOUNDS AND DERIVATIVES THEREOF FOR TREATING PAIN FEVER AND INFLAMMATION | WILLIAM H. RORER, INC. (US) | 1978-02-21 | — | — | US | claimed |