Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 4/20 | 0.39 |
| ▸ | MAOA | P21397 | 3/20 | 0.39 |
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.39 |
| ▸ | GSK3A | P49840 | 2/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13886739 | 0.79 | TLR9 (0.46) | TLR9LMNAHTTNPSR1L3MBTL1 | |
| SCHEMBL10783190 | 0.75 | TLR9 (0.42) | TLR9LMNAHTTNPSR1L3MBTL1 | |
| SCHEMBL5906264 | 0.65 | TLR9 (0.40) | TLR9LMNAMAOAMAOBCYP2C9 | |
| SCHEMBL29256181 | 0.65 | ELANE (0.56) | LMNAHTTNPSR1L3MBTL1ELANE | |
| SCHEMBL31476412 | 0.64 | KCNQ2 (0.73) | LMNAHTTNPSR1L3MBTL1ELANE | |
| SCHEMBL7547211 | 0.64 | KCNQ2 (0.73) | LMNAHTTNPSR1L3MBTL1ELANE | |
| Benzoquinone SCHEMBL8469988 | 0.64 | TSHR (0.71) | LMNAL3MBTL1MAOAMAOBKDM4E | |
| Phenylacetic Acid SCHEMBL28190999 | 0.62 | AKR1B1 (0.77) | LMNAHTT | |
| (Chloromethyl)Benzene SCHEMBL11845377 | 0.62 | MAOA (0.44) | TLR9LMNAELANEMAOAMAOB | |
| Benzoquinone SCHEMBL11845391 | 0.62 | MAOA (0.44) | TLR9ELANEMAOAMAOBCYP1A2 |
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-4983324-A | NONLINEAR OPTICAL MATERIALS AND DISPLAY DEVICE | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-01-08 | — | — | US | claimed |
| US-4983324-A | NONLINEAR OPTICAL MATERIALS AND DISPLAY DEVICE | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-01-08 | — | — | US | disclosed |