Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | ALDH3A1 | P30838 | 4/20 | 0.47 |
| ▸ | PKM | P14618 | 3/20 | 0.45 |
| ▸ | VCAM1 | P19320 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ERN1 | O75460 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6520572 | 0.81 | VCAM1 (0.46) | ALDH1A1PKMVCAM1MEN1KMT2A | |
| SCHEMBL6512416 | 0.81 | VCAM1 (0.46) | ALDH1A1PKMVCAM1MEN1KMT2A | |
| SCHEMBL6516541 | 0.81 | VCAM1 (0.44) | ALDH1A1PKMVCAM1LMNAGAA | |
| SCHEMBL6516552 | 0.81 | ALDH1A1 (0.57) | ALDH1A1PKMVCAM1LMNAGAA | |
| SCHEMBL6515638 | 0.81 | ALDH1A1 (0.57) | ALDH1A1PKMVCAM1LMNAGAA | |
| Zinc Ion SCHEMBL6516607 | 0.81 | VCAM1 (0.44) | ALDH1A1PKMVCAM1LMNAGAA | |
| SCHEMBL6518707 | 0.81 | VCAM1 (0.41) | ALDH1A1ALDH3A1PKMVCAM1MEN1 | |
| SCHEMBL6513677 | 0.81 | VCAM1 (0.41) | ALDH1A1ALDH3A1PKMVCAM1MEN1 | |
| Zinc Ion SCHEMBL6516610 | 0.80 | ALDH1A1 (0.55) | ALDH1A1PKMVCAM1LMNAGAA | |
| SCHEMBL6512411 | 0.80 | VCAM1 (0.45) | ALDH1A1PKMVCAM1MEN1KMT2A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111039898-B | Preparation method of metopimazine intermediate | 暨明医药科技（苏州）有限公司 | 2021-12-24 | — | — | CN | claimed |
| CN-111039898-A | Preparation method of metopimazine intermediate | 暨明医药科技（苏州）有限公司 | 2020-04-21 | — | — | CN | claimed |
| CN-111039898-B | Preparation method of metopimazine intermediate | 暨明医药科技（苏州）有限公司 | 2021-12-24 | — | — | CN | disclosed |
| CN-111039898-B | Preparation method of metopimazine intermediate | 暨明医药科技（苏州）有限公司 | 2021-12-24 | — | — | CN | disclosed |
| CN-111039898-A | Preparation method of metopimazine intermediate | 暨明医药科技（苏州）有限公司 | 2020-04-21 | — | — | CN | disclosed |
| CN-111039898-A | Preparation method of metopimazine intermediate | 暨明医药科技（苏州）有限公司 | 2020-04-21 | — | — | CN | disclosed |