Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 3/20 | 0.35 |
| ▸ | CASP7 | P55210 | 3/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 6/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18835214 | 0.78 | P2RX3 (0.39) | P2RX3TRPC5TP53 | |
| SCHEMBL18834830 | 0.77 | TRPC4 (0.43) | ALDH1A1POLBP2RX3TRPC5 | |
| SCHEMBL20432068 | 0.73 | TSHR (0.33) | ALDH1A1HTTTSHRLMNASMN1; SMN2 | |
| SCHEMBL19505584 | 0.73 | P2RX7 (0.39) | ALDH1A1HTTMEN1KMT2AP2RX3 | |
| SCHEMBL18835210 | 0.71 | TRPC5 (0.47) | CYP2C9P2RX3TRPC5DRD2TBXA2R | |
| SCHEMBL18834484 | 0.71 | TRPC5 (0.41) | ALDH1A1MEN1KMT2APOLBP2RX3 | |
| SCHEMBL20432150 | 0.71 | TRPC4 (0.39) | ALDH1A1HTTMAPK1MEN1KMT2A | |
| SCHEMBL16076082 | 0.70 | TRPC5 (0.58) | KMT2APOLBTSHRTRPC5LMNA | |
| SCHEMBL19375380 | 0.70 | MEN1 (0.41) | ALDH1A1MEN1KMT2APOLBP2RX3 | |
| SCHEMBL18835230 | 0.70 | ALDH1A1 (0.41) | ALDH1A1HTTUSP2CYP1A2CYP3A4 |
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-2970303-B3 | SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF | HYDRA BIOSCIENCES INC (US) | 2018-08-01 | — | — | EP | disclosed |