Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.35 |
| ▸ | CASP1 | P29466 | 2/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29358342 | 0.95 | ALDH1A1 (0.55) | ALDH1A1MAPTKDM4EPOLBNPC1 | |
| SCHEMBL29408294 | 0.95 | ALDH1A1 (0.55) | ALDH1A1MAPTKDM4EPOLBNPC1 | |
| SCHEMBL88611 | 0.95 | ALDH1A1 (0.55) | ALDH1A1MAPTKDM4EPOLBNPC1 | |
| Biphenyl SCHEMBL27984062 | 0.83 | ALDH1A1 (0.50) | ALDH1A1MAPTKDM4EPOLBNPC1 | |
| Furan SCHEMBL29037471 | 0.81 | ALDH1A1 (0.43) | ALDH1A1MAPTKDM4EPOLBNPC1 | |
| Piperazine SCHEMBL28097858 | 0.81 | ALDH1A1 (0.43) | ALDH1A1MAPTKDM4ECYP3A4LMNA | |
| SCHEMBL14856779 | 0.78 | ALDH1A1 (0.40) | ALDH1A1MAPTKDM4EPOLBNPC1 | |
| Phthalazine SCHEMBL11491846 | 0.78 | ALDH1A1 (0.56) | ALDH1A1MAPTKDM4EPOLBNPC1 | |
| SCHEMBL8194 | 0.76 | ALDH1A1 (0.67) | ALDH1A1MAPTKDM4EPOLBNPC1 | |
| SCHEMBL30099834 | 0.76 | ALDH1A1 (0.67) | ALDH1A1MAPTKDM4EPOLBNPC1 |
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-107004768-B | Organic semiconductor composition containing a liquid medium | 巴斯夫欧洲公司 | 2020-08-21 | — | — | CN | disclosed |
| CN-101772492-A | N | BASF SE | 2010-07-07 | — | — | CN | disclosed |