Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | HRH2 | P25021 | 1/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | PLK1 | P53350 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ACACB | O00763 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9156027 | 0.89 | NPC1 (0.60) | KMT2AMEN1RECQLCYP2C9CYP2C19 | |
| SCHEMBL12420657 | 0.85 | TP53 (0.57) | KMT2AMEN1CYP2D6TSHRHRH2 | |
| SCHEMBL230405 | 0.83 | NPC1 (0.71) | KMT2AMEN1CYP2D6LMNATSHR | |
| Bromide SCHEMBL7247705 | 0.81 | NPC1 (0.69) | KMT2AMEN1CYP2D6LMNATSHR | |
| Hydrochloric Acid SCHEMBL518416 | 0.81 | KMT2A (0.69) | KMT2AMEN1CYP2D6LMNATSHR | |
| SCHEMBL12420655 | 0.80 | NR4A1 (0.57) | KMT2AMEN1CYP2D6PARP10 | |
| SCHEMBL13540174 | 0.80 | PARP10 (0.62) | KMT2AMEN1CYP2D6PARP10 | |
| SCHEMBL20883790 | 0.80 | MEN1 (0.66) | KMT2AMEN1CYP2D6LMNASMN1; SMN2 | |
| SCHEMBL29003850 | 0.79 | PARP10 (0.47) | KMT2ALMNAPARP10NPC1PLK1 | |
| SCHEMBL14638127 | 0.79 | KMT2A (0.50) | KMT2AMEN1CYP2D6CYP2C9CYP2C19 |
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-0970089-A2 | PYRROLOTHIAZINE AND PYRROLOTHIAZEPINE COMPOUNDS HAVING SEROTONIN-2 RECEPTOR ANTAGONISTIC AND ALPHA-1-BLOCKING ACTION | SUNTORY LIMITED (JP) | 2000-01-12 | — | — | EP | disclosed |
| WO-1999033841-A2 | PYRROLOTHIAZINE AND PYRROLOTHIAZEPINE COMPOUNDS HAVING SEROTONIN-2 RECEPTOR ANTAGONISTIC AND ALPHA-1-BLOCKING ACTION | SUNTORY LIMITED (JP) | 1999-07-08 | — | — | WO | disclosed |