Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | SRC | P12931 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8962725 | 0.89 | ALDH1A1 (0.48) | ALDH1A1HPGDHTTSMN1; SMN2LMNA | |
| SCHEMBL908602 | 0.84 | ALDH1A1 (0.55) | ALDH1A1HPGDHTTSMN1; SMN2LMNA | |
| SCHEMBL29538287 | 0.84 | ALDH1A1 (0.55) | ALDH1A1HPGDHTTSMN1; SMN2LMNA | |
| SCHEMBL29125481 | 0.80 | ERN1 (0.41) | ALDH1A1HPGDKMT2AMEN1L3MBTL1 | |
| SCHEMBL2934551 | 0.79 | LMNA (0.52) | ALDH1A1HPGDHTTSMN1; SMN2LMNA | |
| SCHEMBL10600901 | 0.79 | KMT2A (0.35) | ALDH1A1HTTSMN1; SMN2KMT2ADRD1 | |
| SCHEMBL6898729 | 0.78 | ALDH1A1 (0.48) | ALDH1A1HPGDHTTSMN1; SMN2LMNA | |
| SCHEMBL28881054 | 0.77 | ALDH1A1 (0.47) | ALDH1A1HPGDHTTSMN1; SMN2LMNA | |
| SCHEMBL11333288 | 0.76 | ALDH1A1 (0.55) | ALDH1A1HPGDHTTSMN1; SMN2LMNA | |
| SCHEMBL177279 | 0.76 | ALDH1A1 (0.55) | ALDH1A1HPGDHTTSMN1; SMN2LMNA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2204471-A | — | — | None | — | — | JP | disclosed |
| CN-1013671-B | PREPARATION METHOD FOR PYRAZOLINES | SCHERING AG (DE) | 1991-08-28 | — | — | CN | disclosed |
| JP-H02204471-A | PRODUCTION OF ARYLMETHYL (TRIFLUOROETHOXYPHENYL)KETONE | RHONE POULENC CHIM | 1990-08-14 | — | — | JP | disclosed |
| CN-86108628-A | Preparation method for pyrazolines | — | 1987-07-01 | — | — | CN | disclosed |
| US-4256749-A | HYPOTENSIVE AGENTS, CIRCULATION | BAYER AKTIENGESELLSCHAFT (DE) | 1981-03-17 | — | — | US | disclosed |