Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PARP14 | Q460N5 | 5/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5630622 | 0.88 | CETP (0.40) | KDM4ECYP2C9CYP1A2RAB9APOLB | |
| SCHEMBL21808760 | 0.83 | RAB9A (0.43) | ALDH1A1KDM4ESMN1; SMN2CYP2C19CYP2C9 | |
| SCHEMBL27917178 | 0.83 | MAPT (0.32) | — | |
| SCHEMBL27232787 | 0.80 | HDAC1 (0.44) | KDM4E | |
| SCHEMBL27827079 | 0.74 | AKR1B1 (0.36) | KDM4ECYP1A2 | |
| SCHEMBL28035585 | 0.72 | — | — | |
| SCHEMBL28218445 | 0.72 | ALDH1A1 (0.34) | ALDH1A1HSD17B10 | |
| SCHEMBL28267207 | 0.72 | ALDH1A1 (0.34) | ALDH1A1HSD17B10 | |
| SCHEMBL28088146 | 0.72 | ALDH1A1 (0.34) | ALDH1A1HSD17B10 | |
| SCHEMBL28268018 | 0.70 | ALDH1A1 (0.32) | ALDH1A1SMN1; SMN2HSD17B10MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101402727-B | Two-dimension netted metalloporphyrin polymer with controllable bore diameter and uses thereof | UNIV SHANDONG TECHNOLOGY | 2010-11-17 | — | — | CN | disclosed |
| CN-101402727-A | Two-dimension netted metalloporphyrin polymer with controllable bore diameter and uses thereof | UNIV SHANDONG TECHNOLOGY (CN) | 2009-04-08 | — | — | CN | disclosed |