Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC5 | P28715 | 3/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.38 |
| ▸ | FSCN1 | Q16658 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PARG | Q86W56 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2308886 | 0.83 | MEN1 (0.48) | KDM4EPOLBTP53 | |
| SCHEMBL14828572 | 0.82 | PTGDR2 (0.47) | ERCC5GABRA1GABRA5KDM4E | |
| SCHEMBL14828565 | 0.81 | PTGDR2 (0.42) | KDM4ETP53MAPT | |
| SCHEMBL14828548 | 0.81 | PTGDR2 (0.47) | POLBTP53MAPT | |
| SCHEMBL2306409 | 0.80 | GRIN1 (0.36) | GRIN1GRIN2BPOLB | |
| SCHEMBL14828532 | 0.79 | GLP1R (0.35) | POLB | |
| SCHEMBL2308318 | 0.79 | FNTA (0.37) | POLBTP53MAPTPARG | |
| SCHEMBL2313628 | 0.79 | HTR2A (0.36) | ERCC5POLB | |
| SCHEMBL14828515 | 0.79 | FEN1 (0.36) | ERCC5POLBTP53MAPT | |
| SCHEMBL2832433 | 0.79 | LMNA (0.38) | KDM4EPOLBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-8415373-B2 | Isoquinolinone derivatives as NK3 antagonists | H. LUNDBECK A/S (DK) | 2013-04-09 | — | — | US | claimed |
| US-8415373-B2 | Isoquinolinone derivatives as NK3 antagonists | H. LUNDBECK A/S (DK) | 2013-04-09 | — | — | US | disclosed |