Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 8/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12112239 | 0.92 | MEN1 (0.41) | PIK3CDADORA2A | |
| SCHEMBL12112236 | 0.91 | PIK3CD (0.47) | PIK3CDADORA2AADORA1HPGDTSHR | |
| SCHEMBL16123777 | 0.89 | PIK3CD (0.41) | PIK3CDADORA2AADORA1HPGDTSHR | |
| SCHEMBL12112237 | 0.88 | PDE4A (0.42) | PIK3CDADORA2AADORA1HPGDTSHR | |
| SCHEMBL15214178 | 0.88 | PIK3CD (0.40) | PIK3CDADORA2AADORA1HPGDTSHR | |
| SCHEMBL12112243 | 0.88 | PIK3CD (0.40) | PIK3CDADORA2AADORA1HPGDTSHR | |
| SCHEMBL15214193 | 0.88 | SLC29A1 (0.46) | PIK3CDADORA2AADORA1HPGDTSHR | |
| SCHEMBL15214194 | 0.82 | PIK3CD (0.35) | PIK3CDADORA2AADORA1HPGDTSHR | |
| SCHEMBL12112229 | 0.81 | SLC29A1 (0.43) | PIK3CDADORA2AHPGDLMNAALDH1A1 | |
| SCHEMBL12112232 | 0.81 | PIK3CD (0.39) | PIK3CDADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010039187-A2 | FUSED DIIMIDAZODIAZEPINE COMPOUNDS AND METHODS OF USE AND MANUFACTURE THEREOF | UNIVERSITY OF MARYLAND, BALTIMORE COUNTY (US) | 2010-04-08 | — | — | WO | disclosed |