Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | POLQ | O75417 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | RORB | Q92753 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL162605 | 0.80 | PDE2A (0.41) | PDE2AMAPTALDH1A1MEN1KMT2A | |
| SCHEMBL163538 | 0.80 | GABRA1 (0.43) | ALDH1A1SMN1; SMN2MEN1KMT2AMCL1 | |
| SCHEMBL29648890 | 0.80 | PDE2A (0.41) | PDE2AMAPTALDH1A1MEN1KMT2A | |
| SCHEMBL27701883 | 0.70 | TDP1 (0.36) | ALDH1A1MAPK1TDP1 | |
| SCHEMBL11872782 | 0.70 | TDP1 (0.38) | PDE2AALDH1A1MAPK1TDP1 | |
| SCHEMBL11624082 | 0.70 | CYP3A4 (0.40) | MAPTNPSR1ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL8746808 | 0.70 | TSHR (0.50) | ALDH1A1MAPK1TDP1 | |
| SCHEMBL10905501 | 0.70 | CES2 (0.46) | PDE2AALDH1A1TDP1POLQ | |
| SCHEMBL31135862 | 0.70 | CES2 (0.46) | PDE2AALDH1A1TDP1POLQ | |
| SCHEMBL28211238 | 0.69 | GABRA1 (0.45) | ALDH1A1HTTSMN1; SMN2MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106232666-A | Post-modification polycarbodiimide | 巴斯夫欧洲公司 | 2016-12-14 | — | — | CN | disclosed |