Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.66 |
| ▸ | GLA | P06280 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.49 |
| ▸ | KIF11 | P52732 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL27931850 | 1.00 | ALDH1A1 (0.66) | ALDH1A1GLATSHRCYP1A2ADRB2 | |
| SCHEMBL27916978 | 1.00 | ALDH1A1 (0.66) | ALDH1A1GLATSHRCYP1A2ADRB2 | |
| SCHEMBL1305355 | 0.84 | ALDH1A1 (0.62) | ALDH1A1GLATSHRCYP1A2ADRB2 | |
| SCHEMBL14307663 | 0.83 | ADRB2 (0.78) | GLATSHRCYP1A2ADRB2ADRB1 | |
| SCHEMBL5181351 | 0.83 | MAPT (0.64) | ALDH1A1TSHRCYP1A2MEN1KMT2A | |
| SCHEMBL8092742 | 0.81 | ALDH1A1 (0.58) | ALDH1A1GLATSHRCYP1A2ADRB2 | |
| SCHEMBL4251914 | 0.81 | ALDH1A1 (0.58) | ALDH1A1GLATSHRCYP1A2ADRB2 | |
| SCHEMBL4251911 | 0.81 | ALDH1A1 (0.58) | ALDH1A1GLATSHRCYP1A2ADRB2 | |
| SCHEMBL4256316 | 0.81 | ALDH1A1 (0.58) | ALDH1A1GLATSHRCYP1A2ADRB2 | |
| SCHEMBL10204649 | 0.80 | RXFP1 (0.56) | ALDH1A1TSHRCYP1A2ADRB2ADRB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103058957-A | NMDA receptor antagonists for neuroprotection | UNIV EMORY | 2013-04-24 | — | — | CN | disclosed |