Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | ACACA | Q13085 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 4/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17985448 | 1.00 | IDO1 (0.40) | IDO1HTR2CALDH1A1HPGDHTT | |
| SCHEMBL17986628 | 0.88 | SERPINE1 (0.39) | IDO1HTR2CALDH1A1HPGDHTT | |
| SCHEMBL14797777 | 0.88 | NQO2 (0.41) | HTR2CALDH1A1HPGDKDM4EACACB | |
| SCHEMBL21335602 | 0.88 | SERPINE1 (0.39) | IDO1HTR2CALDH1A1HPGDHTT | |
| SCHEMBL14797776 | 0.88 | NQO2 (0.41) | HTR2CALDH1A1HPGDKDM4EACACB | |
| SCHEMBL14802708 | 0.87 | SERPINE1 (0.38) | HTR2CALDH1A1HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL14802654 | 0.86 | HTR2C (0.44) | HTR2CHTR2BHTR2ASERPINE1 | |
| SCHEMBL17986378 | 0.84 | HTR2C (0.60) | HTR2CHTR2BHTR2A | |
| SCHEMBL17986302 | 0.84 | HTR2C (0.43) | HTR2CHTR2BHTR2A | |
| SCHEMBL17985446 | 0.83 | HTR2A (0.50) | IDO1HTR2CACACBACACADRD2 |
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-3250549-B1 | CYCLOPROPYLMETHANAMINES AS SELECTIVE 5-HT(2C) RECEPTOR AGONISTS | UNIV ILLINOIS (US) | 2021-06-23 | — | — | EP | disclosed |