Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.54 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | CA2 | P00918 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 2/20 | 0.45 |
| ▸ | FYN | P06241 | 2/20 | 0.45 |
| ▸ | MMP9 | P14780 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CA4 | P22748 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11611313 | 0.81 | GABRA1 (0.56) | GABRA1GABRB2TSHRALDH1A1CA2 | |
| SCHEMBL11504087 | 0.80 | GABRA1 (0.62) | GABRA1GABRB2TSHRALDH1A1CA2 | |
| SCHEMBL30195663 | 0.80 | GABRA1 (0.62) | GABRA1GABRB2TSHRALDH1A1CA2 | |
| SCHEMBL196228 | 0.78 | GABRA1 (0.59) | GABRA1GABRB2TSHRALDH1A1CA2 | |
| SCHEMBL11510792 | 0.77 | GABRA1 (0.52) | GABRA1GABRB2TSHRALDH1A1CA2 | |
| SCHEMBL990718 | 0.77 | GABRA1 (0.65) | GABRA1GABRB2TSHRALDH1A1CA2 | |
| SCHEMBL7782324 | 0.76 | GABRA1 (0.56) | GABRA1GABRB2TSHRALDH1A1CA2 | |
| SCHEMBL30194816 | 0.75 | GABRA1 (0.62) | GABRA1GABRB2TSHRALDH1A1CA2 | |
| SCHEMBL133407 | 0.75 | GABRA1 (0.62) | GABRA1GABRB2TSHRALDH1A1CA2 | |
| SCHEMBL29407501 | 0.75 | GABRA1 (0.62) | GABRA1GABRB2TSHRALDH1A1CA2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109678796-A | PD-1/PD-L1 micromolecular inhibitor and its preparation method and application | 上海长森药业有限公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-105008331-B | Act on multiple prostaglandin receptors, produce the compound of general anti-inflammatory response | 阿勒根公司 | 2018-02-16 | — | — | CN | disclosed |
| US-6441112-B1 | TADDOL and titanium ( ) taddolate dendrimers and composition | NOVARTIS AG (CH) | 2002-08-27 | — | — | US | disclosed |
| US-6211316-B1 | Taddol and titanium (IV) taddolate dendrimers | NOVARTIS AG (CH) | 2001-04-03 | — | — | US | disclosed |