Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.58 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2915967 | 0.83 | AOC3 (0.61) | TDP1TSHRSMN1; SMN2HTTMAPT | |
| SCHEMBL2915970 | 0.83 | AOC3 (0.61) | TDP1TSHRSMN1; SMN2HTTMAPT | |
| SCHEMBL2915961 | 0.83 | AOC3 (0.61) | TDP1TSHRSMN1; SMN2HTTMAPT | |
| Hydrochloric Acid SCHEMBL2923259 | 0.81 | AOC3 (0.59) | TDP1TSHRSMN1; SMN2HTTMAPT | |
| SCHEMBL2922246 | 0.81 | CYP2C19 (0.65) | TDP1TSHRSMN1; SMN2ALDH1A1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL2923262 | 0.81 | AOC3 (0.59) | TDP1TSHRSMN1; SMN2HTTMAPT | |
| Hydrochloric Acid SCHEMBL2923263 | 0.81 | AOC3 (0.59) | TDP1TSHRSMN1; SMN2HTTMAPT | |
| 2,4-Dichlorophenoxyacetic Acid SCHEMBL19462973 | 0.78 | TDP1 (0.84) | TDP1TSHRSMN1; SMN2ALDH1A1L3MBTL1 | |
| SCHEMBL22591956 | 0.76 | TDP1 (0.62) | TDP1TSHRSMN1; SMN2ALDH1A1L3MBTL1 | |
| SCHEMBL9974137 | 0.76 | TDP1 (0.72) | TDP1TSHRSMN1; SMN2ALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2222160-A2 | HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR | Pharmaxis Ltd. (AU) | 2010-09-01 | — | — | EP | disclosed |
| WO-2009066152-A2 | HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR | PHARMAXIS LTD. (US) | 2009-05-28 | — | — | WO | disclosed |