Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 3/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.43 |
| ▸ | CDK9 | P50750 | 2/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | CFD | P00746 | 3/20 | 0.40 |
| ▸ | F11 | P03951 | 3/20 | 0.40 |
| ▸ | TPSB2 | P20231 | 3/20 | 0.40 |
| ▸ | PLG | P00747 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.40 |
| ▸ | F7 | P08709 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23843054 | 0.85 | MRGPRX4 (0.46) | MRGPRX4CCNT1CDK9NPC1RAB9A | |
| SCHEMBL19970812 | 0.81 | KMT2A (0.48) | MRGPRX4CCNT1CDK9HTR1ASMN1; SMN2 | |
| SCHEMBL9814951 | 0.80 | HTR1A (0.51) | ABCB1HTR1ADRD2GAAKDM4E | |
| SCHEMBL19970725 | 0.80 | HTR6 (0.41) | MRGPRX4CCNT1CDK9ABCB1HTR1A | |
| SCHEMBL3390402 | 0.78 | CCNT1 (0.46) | CCNT1CDK9MAPT | |
| SCHEMBL5644007 | 0.74 | SLC1A5 (0.54) | ABCB1HTR1ADRD2LMNAMAPT | |
| SCHEMBL23843006 | 0.74 | HTR6 (0.48) | HTR1A | |
| SCHEMBL1011307 | 0.74 | MAOB (0.53) | — | |
| SCHEMBL5301923 | 0.74 | POLB (0.45) | CCNT1CDK9MAPT | |
| SCHEMBL9169993 | 0.73 | HTR1A (0.40) | MRGPRX4ABCB1HTR1ADRD2NPC1 |
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-3296297-A1 | BENZIMIDAZOL DERIVATIVES FOR TREATING FILOVIRUS INFECTION | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2018-03-21 | — | — | EP | disclosed |