Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | HTR2B | P41595 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 4/20 | 0.34 |
| ▸ | CCND1 | P24385 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6556316 | 1.00 | HTR2A (0.37) | HTR2AHTR2CHTR2BMAPTALDH1A1 | |
| SCHEMBL6556390 | 1.00 | HTR2A (0.37) | HTR2AHTR2CHTR2BMAPTALDH1A1 | |
| SCHEMBL6556400 | 1.00 | HTR2A (0.37) | HTR2AHTR2CHTR2BMAPTALDH1A1 | |
| Fumaric Acid SCHEMBL7868759 | 0.91 | TSHR (0.35) | HTR2AHTR2CHTR2BMAPTALDH1A1 | |
| Fumaric Acid SCHEMBL6556476 | 0.91 | TSHR (0.35) | HTR2AHTR2CHTR2BMAPTALDH1A1 | |
| Fumaric Acid SCHEMBL6556317 | 0.91 | TSHR (0.35) | HTR2AHTR2CHTR2BMAPTALDH1A1 | |
| SCHEMBL6556509 | 0.85 | SIGMAR1 (0.46) | HTR2AHTR2CHTR2BSIGMAR1 | |
| SCHEMBL6556524 | 0.81 | MAPT (0.46) | HTR2AHTR2CHTR2BMAPTALDH1A1 | |
| SCHEMBL6556519 | 0.81 | MAPT (0.46) | HTR2AHTR2CHTR2BMAPTALDH1A1 | |
| SCHEMBL10249398 | 0.79 | CDK4 (0.35) | MAPTALDH1A1MEN1CYP1A2KMT2A |
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-0958285-B1 | TRICYCLIC BENZO[e]ISOINDOLES AND BENZO[h]ISOQUINOLINES | HOFFMANN LA ROCHE (CH) | 2004-01-07 | — | — | EP | disclosed |
| US-6310208-B1 | Serotonin receptor binding benzo[e]isoindoles and benzo[h]isoquinolines | HOFFMANN-LA ROCHE INC. | 2001-10-30 | — | — | US | disclosed |