Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ACACB | O00763 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | CTSG | P08311 | 1/20 | 0.46 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.46 |
| ▸ | CMA1 | P23946 | 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 | |
|---|---|---|---|---|
| SCHEMBL1185757 | 0.86 | RAB9A (0.58) | RAB9AALDH1A1HPGDNPC1SMN1; SMN2 | |
| SCHEMBL28242828 | 0.85 | ALDH1A1 (0.48) | RAB9AALDH1A1HPGDNPC1SMN1; SMN2 | |
| SCHEMBL28242850 | 0.85 | ALDH1A1 (0.48) | RAB9AALDH1A1HPGDNPC1SMN1; SMN2 | |
| SCHEMBL7671463 | 0.84 | RAB9A (0.50) | RAB9AALDH1A1HPGDNPC1SMN1; SMN2 | |
| SCHEMBL8072402 | 0.84 | PPARG (0.53) | RAB9AALDH1A1HPGDNPC1SMN1; SMN2 | |
| SCHEMBL8076395 | 0.84 | PPARG (0.53) | RAB9AALDH1A1HPGDNPC1SMN1; SMN2 | |
| SCHEMBL8063792 | 0.84 | PPARG (0.53) | RAB9AALDH1A1HPGDNPC1SMN1; SMN2 | |
| SCHEMBL27555268 | 0.84 | CTRB1 (0.53) | RAB9AALDH1A1NPC1SMN1; SMN2MEN1 | |
| SCHEMBL8972788 | 0.83 | RAB9A (0.55) | RAB9AALDH1A1HPGDNPC1SMN1; SMN2 | |
| SCHEMBL11008452 | 0.83 | ALDH1A1 (0.46) | RAB9AALDH1A1HPGDNPC1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108586272-A | A kind of preparation method of 3- aminopropanols or 3- alanine derivatives | 浙江昌明药业有限公司 | 2018-09-28 | — | — | CN | disclosed |
| US-5518903-A | HYDROLYSIS OF ESTER | CHISSO CORPORATION (JP) | 1996-05-21 | — | — | US | disclosed |