Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 13/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.42 |
| ▸ | CCR1 | P32246 | 2/20 | 0.41 |
| ▸ | CCR5 | P51681 | 2/20 | 0.41 |
| ▸ | CCR8 | P51685 | 2/20 | 0.41 |
| ▸ | METAP1 | P53582 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11363871 | 0.97 | ADORA3 (0.50) | ADORA3HSP90AA1KDM4ELMNANPC1 | |
| SCHEMBL11361335 | 0.97 | ADORA3 (0.50) | ADORA3HSP90AA1KDM4ELMNANPC1 | |
| SCHEMBL10389484 | 0.89 | ADORA3 (0.55) | ADORA3HSP90AA1KDM4ELMNANPC1 | |
| SCHEMBL11359496 | 0.85 | ADORA3 (0.47) | ADORA3KDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL11374228 | 0.83 | MEN1 (0.46) | ADORA3HSP90AA1KDM4ELMNANPC1 | |
| SCHEMBL935285 | 0.82 | MEN1 (0.57) | ADORA3KDM4ELMNANPC1RAB9A | |
| SCHEMBL11366956 | 0.81 | CCR1 (0.43) | ADORA3KDM4EALDH1A1HPGDCCR1 | |
| SCHEMBL11361419 | 0.80 | MEN1 (0.46) | ADORA3HSP90AA1KDM4ELMNANPC1 | |
| SCHEMBL11370414 | 0.79 | ADRA2A (0.38) | KDM4ENPC1ALDH1A1RAB9AMEN1 | |
| SCHEMBL11367058 | 0.78 | CCR1 (0.43) | ADORA3KDM4EALDH1A1HPGDCCR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4269834-A | Copper complexes of isoquinazolines | NAUTA WIJBE T | 1981-05-26 | — | — | US | disclosed |