Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.35 |
| ▸ | CHUK | O15111 | 5/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ICOSLG | O75144 | 1/20 | 0.32 |
| ▸ | ICOS | Q9Y6W8 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.30 |
| ▸ | HPGD | P15428 | 2/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | SYK | P43405 | 1/20 | 0.30 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17737480 | 0.78 | FFAR4 (0.46) | CYP3A4CHUKLMNAALDH1A1TP53 | |
| SCHEMBL22536978 | 0.76 | MAPT (0.38) | CYP3A4CYP3A5KDM4CLMNAALDH1A1 | |
| SCHEMBL22667955 | 0.70 | PHGDH (0.33) | LMNATRPV1 | |
| SCHEMBL16918626 | 0.68 | LMNA (0.35) | CYP3A4CYP3A5LMNAALDH1A1TP53 | |
| SCHEMBL22667905 | 0.67 | MALT1 (0.34) | CYP3A4CYP3A5TRPV1 | |
| SCHEMBL22536986 | 0.65 | ALDH1A1 (0.53) | CYP3A4LMNAALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL17737683 | 0.63 | SMN1; SMN2 (0.41) | LMNAALDH1A1TP53POLBHPGD | |
| SCHEMBL17737455 | 0.63 | IDO1 (0.55) | LMNAALDH1A1HTTTRPV1 | |
| SCHEMBL31588898 | 0.62 | CACNA2D1 (0.47) | CYP3A4KDM4CLMNAALDH1A1TP53 | |
| SCHEMBL22536981 | 0.62 | LMNA (0.45) | KDM4CLMNAALDH1A1SMN1; SMN2TRPV1 |
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-3215155-B1 | INHIBITORS OF TRYPTOPHAN-2,3-DIOXYGENASE OR INDOLEAMINE-2,3-DIOXYGENASE | IOMET PHARMA LTD (GB) | 2020-10-14 | — | — | EP | disclosed |