Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL4301396 | 0.86 | KMT2A (0.43) | KMT2ANPSR1MEN1ALDH1A1POLB | |
| SCHEMBL4301494 | 0.85 | MRGPRX4 (0.44) | KMT2ANPSR1MEN1ALDH1A1POLB | |
| SCHEMBL4306365 | 0.82 | LMNA (0.45) | KMT2AMEN1ALDH1A1POLBKDM4E | |
| SCHEMBL4313102 | 0.82 | CDYL2 (0.52) | KMT2AMEN1ALDH1A1POLBCES2 | |
| SCHEMBL4304477 | 0.78 | TP53BP1 (0.38) | KMT2ANPSR1ALDH1A1NPC1RAB9A | |
| SCHEMBL4305020 | 0.76 | LMNA (0.46) | KMT2AMEN1ALDH1A1TAS1R3TAS1R1 | |
| SCHEMBL31355711 | 0.74 | CES2 (0.65) | KMT2ANPSR1MEN1ALDH1A1POLB | |
| SCHEMBL40351 | 0.74 | CES2 (0.65) | KMT2ANPSR1MEN1ALDH1A1POLB | |
| SCHEMBL25308923 | 0.74 | NPSR1 (0.54) | KMT2ANPSR1MEN1ALDH1A1POLB | |
| Ethane SCHEMBL27386119 | 0.73 | CES2 (0.62) | KMT2ANPSR1MEN1ALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009130231-A1 | PYRROLO [1, 2-A] PYRAZINE DERIVATIVES AS VASOPRESSIN VIB RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2009-10-29 | — | — | WO | disclosed |
| WO-2009130231-A1 | PYRROLO [1, 2-A] PYRAZINE DERIVATIVES AS VASOPRESSIN VIB RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2009-10-29 | — | — | WO | disclosed |