Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 7/20 | 0.40 |
| ▸ | DRD2 | P14416 | 5/20 | 0.40 |
| ▸ | HTR1D | P28221 | 5/20 | 0.39 |
| ▸ | HTR1B | P28222 | 5/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.39 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16361881 | 0.87 | HTR1A (0.41) | HTR1AHTR1DHTR1BSLC6A4KCNH2 | |
| SCHEMBL29736794 | 0.84 | SMYD3 (0.45) | HTR1ADRD2HTR1DHTR1BSLC6A4 | |
| SCHEMBL2380905 | 0.84 | SMYD3 (0.45) | HTR1ADRD2HTR1DHTR1BSLC6A4 | |
| SCHEMBL3593642 | 0.72 | HTR1A (0.41) | HTR1AHTR1DHTR1BSLC6A4KCNH2 | |
| SCHEMBL2172798 | 0.71 | PKM (0.44) | KMT2ASMYD3BRD4CREBBP | |
| SCHEMBL14867323 | 0.70 | HTR1A (0.44) | HTR1AHTR1DHTR1BSLC6A4KCNH2 | |
| SCHEMBL4484367 | 0.69 | NPC1 (0.41) | HTR1AKMT2ASMYD3BRD4CREBBP | |
| SCHEMBL474683 | 0.69 | TERT (0.47) | HTR1AHTR1DHTR1BSLC6A4KCNH2 | |
| SCHEMBL1851941 | 0.69 | CREBBP (0.58) | HTR1ADRD2HTR1DHTR1BSLC6A4 | |
| SCHEMBL254031 | 0.69 | SMYD3 (0.48) | HTR1ADRD2KMT2ASMYD3BRD4 |
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-4010335-A1 | SHP2 INHIBITORS | IRBM S.P.A. (IT) | 2022-06-15 | — | — | EP | disclosed |
| WO-2021028362-A1 | SHP2 INHIBITORS | IRBM S.P.A. (IT) | 2021-02-18 | — | — | WO | disclosed |