Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.47 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | TLR2 | O60603 | 1/20 | 0.45 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.45 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11415378 | 1.00 | PTGS2 (0.50) | PTGS2LMNACYP1A2CYP2C9AKR1C3 | |
| SCHEMBL11415296 | 0.88 | CYP1A2 (0.54) | LMNACYP1A2CYP2C9SIRT2CA1 | |
| SCHEMBL11410869 | 0.88 | CYP1A2 (0.54) | LMNACYP1A2CYP2C9SIRT2CA1 | |
| SCHEMBL11412348 | 0.84 | CA2 (0.51) | LMNACYP1A2CYP2C9AKR1C3SIRT2 | |
| SCHEMBL11412346 | 0.84 | CA2 (0.51) | LMNACYP1A2CYP2C9AKR1C3SIRT2 | |
| SCHEMBL11415373 | 0.84 | CYP1A2 (0.48) | LMNACYP1A2CYP2C9AKR1C3SIRT2 | |
| SCHEMBL11415370 | 0.84 | CYP1A2 (0.48) | LMNACYP1A2CYP2C9AKR1C3SIRT2 | |
| SCHEMBL11416360 | 0.83 | ALDH1A1 (0.55) | PTGS2LMNACYP1A2CYP2C9ALDH1A1 | |
| SCHEMBL28740057 | 0.83 | CA1 (0.51) | PTGS2LMNASIRT2CA1CA2 | |
| SCHEMBL11141904 | 0.81 | LMNA (0.49) | PTGS2LMNACYP1A2CYP2C9AKR1C3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4200648-A | INFLAMMATION BY ADMINISTERING A BENZYLIDENEANILINE DERIVATIVE | WILLIAM H. RORER, INC. (US) | 1980-04-29 | — | — | US | disclosed |
| US-4198349-A | ANTIINFLAMMATORY, TOPICAL | WILLIAM H. RORER, INC. (US) | 1980-04-15 | — | — | US | disclosed |