Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | P4HB | P07237 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.36 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.36 |
| ▸ | ERN1 | O75460 | 2/20 | 0.35 |
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL8020013 | 0.88 | GRIN2B (0.39) | LMNATAS1R3TAS1R1TAS1R2MAPT | |
| SCHEMBL4311981 | 0.85 | LMNA (0.44) | LMNATAS1R3TAS1R1TAS1R2MAPT | |
| SCHEMBL4301396 | 0.82 | KMT2A (0.43) | TAS1R3TAS1R1MAPTALDH1A1KDM4E | |
| SCHEMBL4306412 | 0.81 | KMT2A (0.42) | LMNAMAPTALDH1A1GRIN2BERN1 | |
| SCHEMBL4308531 | 0.78 | LMNA (0.43) | LMNAMAPTALDH1A1KDM4E | |
| SCHEMBL4306380 | 0.78 | CYP1A2 (0.43) | LMNAMAPTALDH1A1TP53KDM4E | |
| SCHEMBL4302800 | 0.76 | CDYL2 (0.49) | LMNAMAPTALDH1A1TP53KDM4E | |
| SCHEMBL20139218 | 0.73 | ALDH1A1 (0.38) | NOTUMMAPTALDH1A1LDHAHDAC8 | |
| SCHEMBL16320824 | 0.73 | ALDH1A1 (0.42) | LMNAMAPTALDH1A1HDAC8KDM4E | |
| SCHEMBL14012580 | 0.72 | NOTUM (0.64) | LMNAP4HBNOTUMTAS1R3TAS1R1 |
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-2009130231-A1 | PYRROLO [1, 2-A] PYRAZINE DERIVATIVES AS VASOPRESSIN VIB RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2009-10-29 | — | — | WO | disclosed |