Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 4/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4967068 | 0.80 | ATM (0.58) | ATMALDH1A1LMNAPOLBNPSR1 | |
| SCHEMBL9725963 | 0.80 | ALDH1A1 (0.67) | ATMALDH1A1LMNAPOLBNPSR1 | |
| SCHEMBL17153801 | 0.78 | ATM (0.78) | ATMALDH1A1LMNAPOLBNPSR1 | |
| SCHEMBL4160892 | 0.77 | ATM (0.75) | ATMALDH1A1LMNAPOLBNPSR1 | |
| SCHEMBL4476411 | 0.76 | ALDH1A1 (0.71) | ATMALDH1A1LMNAPOLBNPSR1 | |
| SCHEMBL9480741 | 0.75 | ATM (0.72) | ATMALDH1A1LMNAPOLBNPSR1 | |
| SCHEMBL19046887 | 0.75 | SLC22A12 (0.71) | ATMALDH1A1LMNAPOLBNPSR1 | |
| Hydrochloric Acid SCHEMBL3519020 | 0.75 | ALDH1A1 (0.69) | ATMALDH1A1LMNAPOLBNPSR1 | |
| SCHEMBL4760099 | 0.75 | ALDH1A1 (0.70) | ATMALDH1A1LMNAPOLBNPSR1 | |
| SCHEMBL4791742 | 0.75 | KMT2A (0.67) | ATMALDH1A1LMNAPOLBNPSR1 |
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-1888563-A1 | PROLINE BIS-AMIDE OREXIN RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 2008-02-20 | — | — | EP | disclosed |
| WO-2006127550-A1 | PROLINE BIS-AMIDE OREXIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2006-11-30 | — | — | WO | disclosed |