Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 7/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 3/20 | 0.41 |
| ▸ | HTR1D | P28221 | 2/20 | 0.41 |
| ▸ | HTR1B | P28222 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL6607580 | 0.83 | HTR1B (0.47) | NOTUMCYP11B2ALDH1A1HPGDHTR1A | |
| SCHEMBL6607581 | 0.83 | HTR1B (0.47) | NOTUMCYP11B2ALDH1A1HPGDHTR1A | |
| SCHEMBL8155948 | 0.83 | NOTUM (0.54) | NOTUMTSHRCYP11B2ALDH1A1KDM4E | |
| SCHEMBL8118270 | 0.82 | NOTUM (0.55) | NOTUMTSHRCYP11B2ALDH1A1KDM4E | |
| SCHEMBL8129693 | 0.82 | SLC2A1 (0.49) | NOTUMTSHRCYP11B2ALDH1A1KDM4E | |
| SCHEMBL8130919 | 0.78 | NOTUM (0.54) | NOTUMTSHRCYP11B2ALDH1A1KDM4E | |
| SCHEMBL8130057 | 0.78 | TSHR (0.46) | NOTUMTSHRCYP11B2ALDH1A1KDM4E | |
| SCHEMBL8133031 | 0.74 | NOTUM (0.60) | NOTUMTSHRALDH1A1KDM4EMAPT | |
| SCHEMBL7067785 | 0.74 | TSHR (0.52) | NOTUMTSHRALDH1A1KDM4EHPGD | |
| SCHEMBL10289633 | 0.71 | NOTUM (0.63) | NOTUMTSHRCYP11B2ALDH1A1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1260781-A | Indole derivatives having combined 5HT1A, 5HT1B and 5HT1D receptor antagonist activity | SMITHKLINE BEECHAM PLC (GB) | 2000-07-19 | — | — | CN | disclosed |
| EP-0975593-A1 | INDOLE DERIVATIVES HAVING COMBINED 5HT1A, 5HT1B AND 5HT1D RECEPTOR ANTAGONIST ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 2000-02-02 | — | — | EP | disclosed |
| WO-1998050358-A1 | INDOLE DERIVATIVES HAVING COMBINED 5HT1A, 5HT1B AND 5HT1D RECEPTOR ANTAGONIST ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 1998-11-12 | — | — | WO | disclosed |