Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | DRD4 | P21917 | 5/20 | 0.32 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.31 |
| ▸ | TNKS | O95271 | 1/20 | 0.31 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 3/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8779431 | 0.86 | CYP1A2 (0.40) | CYP1A2HSD17B10DRD4TNKS2TNKS | |
| SCHEMBL8420151 | 0.78 | TNF (0.43) | CYP1A2ALDH1A1HPGDKDM4E | |
| SCHEMBL8779393 | 0.78 | CYP1A2 (0.37) | CYP1A2HSD17B10TNKS2TNKSPARP3 | |
| SCHEMBL8779469 | 0.76 | TNF (0.42) | CYP1A2ALDH1A1HPGDKDM4E | |
| SCHEMBL8419507 | 0.76 | KDM4E (0.44) | ALDH1A1HPGDKDM4E | |
| SCHEMBL8421376 | 0.74 | TNF (0.56) | HSD17B10ALDH1A1HPGDKDM4E | |
| SCHEMBL8421923 | 0.74 | TNF (0.56) | HSD17B10ALDH1A1HPGDKDM4E | |
| SCHEMBL8779459 | 0.73 | TNF (0.45) | CYP1A2HSD17B10ALDH1A1HPGDKDM4E | |
| SCHEMBL7439026 | 0.72 | TNF (0.53) | — | |
| SCHEMBL8779410 | 0.71 | TNF (0.49) | HSD17B10ALDH1A1HPGDKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0797437-A1 | IMMUNOTHERAPEUTIC IMIDES/AMIDES AND THEIR USE FOR REDUCING LEVELS OF TNF$g(a) | CELGENE CORPORATION (US) | 1997-10-01 | — | — | EP | disclosed |
| WO-1996020705-A1 | IMMUNOTHERAPEUTIC IMIDES/AMIDES AND THEIR USE FOR REDUCING LEVELS OF TNF$g(a) | CELGENE CORPORATION (US) | 1996-07-11 | — | — | WO | disclosed |