Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CRHBP | P24387 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.42 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Nitrobenzene SCHEMBL3237422 | 0.89 | ALDH1A1 (0.73) | ALDH1A1LMNAPOLBMAPTRAB9A | |
| Nitrobenzene SCHEMBL27527397 | 0.89 | ALDH1A1 (0.73) | ALDH1A1LMNAPOLBL3MBTL1MEN1 | |
| Pyrrole SCHEMBL27708626 | 0.80 | ALDH1A1 (0.56) | ALDH1A1LMNAMAPTL3MBTL1MEN1 | |
| Pyridine SCHEMBL28185807 | 0.79 | TSHR (0.39) | TSHR | |
| Pyridine SCHEMBL28328352 | 0.79 | LMNA (0.42) | ALDH1A1LMNAPOLBMAPTRAB9A | |
| Nitrobenzene SCHEMBL9274922 | 0.79 | ALDH1A1 (0.57) | ALDH1A1LMNAPOLBMAPTRAB9A | |
| Dinitrophenylene SCHEMBL28214822 | 0.77 | TSHR (0.71) | ALDH1A1LMNAMAPTRAB9ANPC1 | |
| Nitrobenzene SCHEMBL897631 | 0.76 | ALDH1A1 (0.89) | ALDH1A1LMNAPOLBL3MBTL1MEN1 | |
| Nitrobenzene SCHEMBL11050641 | 0.76 | ALDH1A1 (0.89) | ALDH1A1LMNAPOLBL3MBTL1MEN1 | |
| Nitrobenzene SCHEMBL11144731 | 0.76 | ALDH1A1 (0.89) | ALDH1A1LMNAPOLBL3MBTL1MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108450567-A | A kind of preparation method of preventing hypertension tea oil | 管天球 | 2018-08-28 | — | — | CN | disclosed |
| CN-106362156-A | Saccharide micro-particle carrier, preparation method, use method, and application thereof | 谭淞文 | 2017-02-01 | — | — | CN | disclosed |
| CN-103432133-B | The purposes of nuclear receptor binding agents | GTX公司 | 2016-08-10 | — | — | CN | disclosed |