Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 1/20 | 0.58 |
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | LTA4H | P09960 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Anisole SCHEMBL27446804 | 0.88 | CA4 (0.58) | CA4CES2CES1LTA4HRAB9A | |
| Anisole SCHEMBL7429921 | 0.87 | CA4 (0.64) | CA4CES2CES1LTA4HRAB9A | |
| Anisole SCHEMBL28278961 | 0.87 | CA4 (0.70) | CA4CES2CES1LTA4HRAB9A | |
| Anisole SCHEMBL27466140 | 0.85 | CA4 (0.61) | CA4CES2CES1LTA4HRAB9A | |
| Anisole SCHEMBL2363591 | 0.85 | CA4 (0.61) | CA4CES2CES1LTA4HRAB9A | |
| Anisole SCHEMBL27802956 | 0.85 | CA4 (0.67) | CA4CES2CES1LTA4HRAB9A | |
| Anisole SCHEMBL27648635 | 0.83 | CA4 (0.58) | CA4CES2CES1LTA4HRAB9A | |
| Anisole SCHEMBL27608743 | 0.83 | CA4 (0.58) | CA4CES2CES1LTA4HRAB9A | |
| Anisole SCHEMBL4965675 | 0.82 | CA4 (0.78) | CA4CES2CES1LTA4HRAB9A | |
| Anisole SCHEMBL5864971 | 0.82 | CA4 (0.78) | CA4CES2CES1LTA4HRAB9A |
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-105085494-B | Sodium sugar cotransports 2 inhibitor of body, its preparation method and its pharmaceutical composition and purposes | 中国医学科学院药物研究所 | 2019-07-02 | — | — | CN | disclosed |
| CN-106146450-B | Formoononetin derivative, preparation method and medical usage | 南京华迈生物医药科技有限公司 | 2019-02-15 | — | — | CN | disclosed |
| CN-106146450-A | Formoononetin derivant, its preparation method and medical usage | 南京华迈生物医药科技有限公司 | 2016-11-23 | — | — | CN | disclosed |