Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP1 | P24666 | 3/20 | 0.61 |
| ▸ | PDE5A | O76074 | 2/20 | 0.61 |
| ▸ | IDH1 | O75874 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | GBA1 | P04062 | 3/20 | 0.49 |
| ▸ | CTSS | P25774 | 1/20 | 0.48 |
| ▸ | CTSK | P43235 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL20938766 | 1.00 | ACP1 (0.61) | ACP1PDE5AIDH1KDM4ENPC1 | |
| SCHEMBL8050442 | 1.00 | ACP1 (0.61) | ACP1PDE5AIDH1KDM4ENPC1 | |
| SCHEMBL20402847 | 1.00 | ACP1 (0.61) | ACP1PDE5AIDH1KDM4ENPC1 | |
| SCHEMBL15094375 | 0.91 | NPY5R (0.58) | ACP1PDE5AIDH1KDM4ERAB9A | |
| SCHEMBL22271262 | 0.91 | NPY5R (0.58) | ACP1PDE5AIDH1KDM4ERAB9A | |
| SCHEMBL24343055 | 0.90 | IDH1 (0.73) | ACP1PDE5AIDH1KDM4ENPC1 | |
| SCHEMBL18520785 | 0.90 | IDH1 (0.73) | ACP1PDE5AIDH1KDM4ENPC1 | |
| SCHEMBL19486676 | 0.90 | IDH1 (0.73) | ACP1PDE5AIDH1KDM4ENPC1 | |
| SCHEMBL18520532 | 0.90 | IDH1 (0.73) | ACP1PDE5AIDH1KDM4ENPC1 | |
| SCHEMBL16392996 | 0.90 | IDH1 (0.73) | ACP1PDE5AIDH1KDM4ENPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9579324-B2 | Therapeutically active compounds and their methods of use | AGIOS PHARMACEUTICALS, INC (US) | 2017-02-28 | — | — | US | disclosed |