Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.48 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | FABP4 | P15090 | 1/20 | 0.40 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.40 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | PARL | Q9H300 | 1/20 | 0.40 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7542901 | 0.88 | IDO1 (0.44) | IDO1NR4A2ALDH1A1MAPTKDM4E | |
| SCHEMBL5870554 | 0.87 | TP53 (0.53) | IDO1ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL7539097 | 0.86 | NR4A2 (0.61) | NR4A2NPC1RAB9AL3MBTL1MAOA | |
| SCHEMBL7542998 | 0.84 | IDO1 (0.41) | IDO1NR4A2TDP1ALDH1A1MAPT | |
| SCHEMBL29257079 | 0.83 | IDO1 (0.49) | IDO1NR4A2TDP1ALDH1A1MAPT | |
| SCHEMBL11706075 | 0.83 | IDO1 (0.46) | IDO1NR4A2ALDH1A1MAPTKDM4E | |
| SCHEMBL777002 | 0.79 | IDO1 (0.48) | IDO1ALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL21591034 | 0.79 | IDO1 (0.48) | IDO1PARL | |
| SCHEMBL10962586 | 0.78 | IDO1 (0.52) | IDO1NR4A2ALDH1A1MAPTKDM4E | |
| SCHEMBL9861114 | 0.78 | IDO1 (0.52) | IDO1NR4A2ALDH1A1MAPTKDM4E |
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-108586706-A | The method for preparing the modified isocyanate mixture containing carbodiimides and/or uretonimine analog derivative | 万华化学集团股份有限公司 | 2018-09-28 | — | — | CN | claimed |
| CN-108586706-A | The method for preparing the modified isocyanate mixture containing carbodiimides and/or uretonimine analog derivative | 万华化学集团股份有限公司 | 2018-09-28 | — | — | CN | disclosed |