Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19193212 | 0.82 | NPSR1 (0.48) | ALDH1A1HTTKMT2ANPSR1GPR35 | |
| SCHEMBL25607340 | 0.80 | ALDH1A1 (0.42) | ALDH1A1HTTKMT2ANPSR1GPR35 | |
| SCHEMBL6796693 | 0.78 | ALDH1A1 (0.56) | ALDH1A1HTTKMT2ANPSR1TDP1 | |
| SCHEMBL5148269 | 0.76 | ALDH1A1 (0.45) | ALDH1A1HTTKMT2AGPR35TDP1 | |
| SCHEMBL5147271 | 0.76 | ALDH1A1 (0.46) | ALDH1A1HTTKMT2AGPR35TDP1 | |
| SCHEMBL5583377 | 0.75 | MAOB (0.57) | ALDH1A1HTTKMT2ANPSR1LMNA | |
| SCHEMBL5047620 | 0.74 | ALDH1A1 (0.41) | ALDH1A1HTTKMT2AGPR35TDP1 | |
| SCHEMBL8751735 | 0.74 | GPR35 (0.42) | ALDH1A1HTTKMT2ANPSR1GPR35 | |
| SCHEMBL7603661 | 0.74 | GPR35 (0.42) | ALDH1A1HTTKMT2ANPSR1GPR35 | |
| SCHEMBL28008005 | 0.73 | ALDH1A1 (0.63) | ALDH1A1HTTKMT2ANPSR1TDP1 |
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-1284960-A1 | CYCLIC AMINO ACID DERIVATIVES USEFUL AS PHARMACEUTICAL AGENTS | WARNER-LAMBERT COMPANY (US) | 2003-02-26 | — | — | EP | disclosed |
| WO-2001090052-A1 | CYCLIC AMINO ACID DERIVATIVES USEFUL AS PHARMACEUTICAL AGENTS | WARNER-LAMBERT COMPANY (US) | 2001-11-29 | — | — | WO | disclosed |