Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | RXRA | P19793 | 1/20 | 0.49 |
| ▸ | RXRB | P28702 | 1/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8580744 | 0.89 | ALDH1A1 (0.68) | ALDH1A1MAPTTP53TSHRKMT2A | |
| SCHEMBL9357856 | 0.87 | ALDH1A1 (0.57) | ALDH1A1MAPTTP53TSHRKMT2A | |
| SCHEMBL9357852 | 0.87 | ALDH1A1 (0.57) | ALDH1A1MAPTTP53TSHRKMT2A | |
| SCHEMBL71380 | 0.86 | TSHR (0.71) | ALDH1A1MAPTTP53TSHRKMT2A | |
| SCHEMBL9318309 | 0.84 | TSHR (0.67) | ALDH1A1MAPTTP53TSHRKMT2A | |
| SCHEMBL8487555 | 0.84 | TSHR (0.67) | ALDH1A1MAPTTP53TSHRKMT2A | |
| SCHEMBL8767088 | 0.84 | TSHR (0.67) | ALDH1A1MAPTTP53TSHRKMT2A | |
| Methane SCHEMBL16836109 | 0.84 | TSHR (0.67) | ALDH1A1MAPTTP53TSHRKMT2A | |
| SCHEMBL10604961 | 0.84 | TSHR (0.67) | ALDH1A1MAPTTP53TSHRKMT2A | |
| Hydrochloric Acid SCHEMBL532752 | 0.84 | TSHR (0.67) | ALDH1A1MAPTTP53TSHRKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-20110165700-A1 | CLASSES OF COMPOUNDS THAT INTERACT WITH INTEGRINS | ALCHEMIA LIMITED (AU) | 2011-07-07 | — | — | US | claimed |
| US-20110165700-A1 | CLASSES OF COMPOUNDS THAT INTERACT WITH INTEGRINS | ALCHEMIA LIMITED (AU) | 2011-07-07 | — | — | US | disclosed |