Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | GABRP | O00591 | 1/20 | 0.38 |
| ▸ | GABRD | O14764 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.38 |
| ▸ | GABRE | P78334 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.38 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.38 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.38 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL28839934 | 0.90 | KMT2A (0.50) | TDP1GABRPGABRDGABRA1TSHR | |
| Tert-Butyl Formate SCHEMBL28125893 | 0.90 | KMT2A (0.50) | TDP1GABRPGABRDGABRA1TSHR | |
| Tert-Butyl Formate SCHEMBL28125977 | 0.88 | TDP1 (0.33) | TDP1GABRPGABRDGABRA1TSHR | |
| Tert-Butyl Formate SCHEMBL27948302 | 0.88 | TDP1 (0.52) | TDP1TSHRALDH1A1GAASMN1; SMN2 | |
| Tert-Butyl Formate SCHEMBL27766674 | 0.85 | TDP1 (0.42) | TDP1GABRPGABRDGABRA1TSHR | |
| Tert-Butyl Formate SCHEMBL28254488 | 0.85 | TDP1 (0.45) | TDP1GABRPGABRDGABRA1TSHR | |
| Tert-Butyl Formate SCHEMBL28279734 | 0.85 | TDP1 (0.45) | TDP1GABRPGABRDGABRA1TSHR | |
| Tert-Butyl Formate SCHEMBL27566302 | 0.83 | TDP1 (0.43) | TDP1GABRPGABRDGABRA1TSHR | |
| Tert-Butyl Formate SCHEMBL28125503 | 0.83 | TDP1 (0.46) | TDP1NOS2KMT2ACYP2D6KDM4E | |
| Tert-Butyl Formate SCHEMBL27751950 | 0.82 | TDP1 (0.50) | TDP1GABRPGABRDGABRA1TSHR |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106103445-B | The therapeutical uses of pyrazolo [1,5-A] pyrimidine -5,7- diamine compound and they as CDK inhibitor | 癌症研究技术有限公司 | 2019-08-09 | — | — | CN | disclosed |
| CN-110099898-A | compound and use thereof | 优曼尼蒂治疗公司 | 2019-08-06 | — | — | CN | disclosed |
| CN-106414448-B | It can be used as the new compound of S100- inhibitor | 活跃生物技术有限公司 | 2019-04-19 | — | — | CN | disclosed |
| CN-106458992-B | Pyridyl piperidine | 默克专利股份公司 | 2019-03-15 | — | — | CN | disclosed |
| CN-106103445-A | Pyrazolo [1,5 A] pyrimidine 5,7 diamine compound and their therapeutic use as CDK inhibitor | 癌症研究技术有限公司 | 2016-11-09 | — | — | CN | disclosed |
| CN-103403002-B | Thiazolylphenyl-benzderivativesido derivativesido as inhibitors of kinases | 内尔维阿诺医学科学有限公司 | 2016-06-22 | — | — | CN | disclosed |
| CN-105399698-A | Aromatic heterocyclic derivatives and applications of aromatic heterocyclic derivatives in medicines | GUANGDONG HEC PHARMACEUTICAL | 2016-03-16 | — | — | CN | disclosed |
| CN-104936953-A | Compound (I) | ASTRAZENECA AB | 2015-09-23 | — | — | CN | disclosed |