Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22268003 | 0.92 | POLB (0.45) | LMNAPKMPOLBCYP2C19HPGD | |
| SCHEMBL19176733 | 0.84 | ATM (0.57) | ATMCYP2C19HPGDALDH1A1HTT | |
| SCHEMBL22161583 | 0.81 | ATM (0.46) | ATMLMNAPOLBHPGDNTRK1 | |
| SCHEMBL19176672 | 0.81 | ATM (0.41) | ATMHPGDNTRK1ALDH1A1 | |
| SCHEMBL19177105 | 0.80 | CCNE1 (0.36) | ATMLMNAPKMPOLBCYP2C19 | |
| SCHEMBL22310669 | 0.74 | NTRK1 (0.39) | ATMPOLBNTRK1ALDH1A1 | |
| SCHEMBL24845990 | 0.73 | ALDH1A1 (0.37) | ATMHPGDKMT2AALDH1A1HTT | |
| SCHEMBL7451736 | 0.72 | SMN1; SMN2 (0.44) | ATMLMNAPKMKMT2AALDH1A1 | |
| SCHEMBL27056225 | 0.72 | HRH3 (0.42) | LMNAPKMPOLBCYP2C19HPGD | |
| SCHEMBL10137836 | 0.72 | HPGD (0.66) | ATMLMNAPKMPOLBHPGD |
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-2016008582-A1 | SUBSTITUTED AZASPIRO(4.5)DECANE DERIVATIVES | Grünenthal GmbH (DE) | 2016-01-21 | — | — | WO | disclosed |