Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.64 |
| ▸ | HTR1A | P08908 | 2/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 1/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
| ▸ | DRD2 | P14416 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | DRD4 | P21917 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | DRD3 | P35462 | 1/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | APEX1 | P27695 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | PARP1 | P09874 | 2/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL10972023 | 0.93 | DRD2 (0.54) | TDP1HTR1ACYP1A2CYP3A4MAPT | |
| SCHEMBL10969078 | 0.88 | HTR1A (0.60) | TDP1HTR1ACYP1A2CYP3A4MAPT | |
| SCHEMBL10968918 | 0.82 | HTR1A (0.62) | TDP1HTR1ACYP1A2CYP3A4MAPT | |
| SCHEMBL10975342 | 0.82 | PARP1 (0.53) | TDP1HTR1ACYP1A2CYP3A4MAPT | |
| Roxindole SCHEMBL49673 | 0.78 | TDP1 (1.00) | TDP1HTR1ACYP1A2CYP3A4MAPT | |
| Roxindole SCHEMBL5605611 | 0.78 | TDP1 (1.00) | TDP1HTR1ACYP1A2CYP3A4MAPT | |
| SCHEMBL10971132 | 0.78 | HTR1A (0.58) | TDP1HTR1ACYP1A2CYP3A4MAPT | |
| Roxindole SCHEMBL5453647 | 0.78 | TDP1 (0.98) | TDP1HTR1ACYP1A2CYP3A4MAPT | |
| SCHEMBL9581622 | 0.76 | TDP1 (0.63) | TDP1HTR1ACYP1A2CYP3A4MAPT | |
| SCHEMBL10355142 | 0.76 | TDP1 (0.85) | TDP1HTR1ACYP1A2CYP3A4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0164633-A2 | Indole derivatives | MERCK PATENT GmbH (DE) | 1985-12-18 | — | — | EP | disclosed |