Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.40 |
| ▸ | PGK1 | P00558 | 1/20 | 0.39 |
| ▸ | PGK2 | P07205 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | IDH1 | O75874 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8464643 | 0.84 | PGK1 (0.37) | TPMTPGK1PGK2ALDH1A1TSHR | |
| SCHEMBL3690305 | 0.82 | ALDH1A1 (0.44) | TPMTPGK1PGK2ALDH1A1TSHR | |
| SCHEMBL7358314 | 0.79 | NOS1 (0.39) | ALDH1A1IDH1FFAR1 | |
| SCHEMBL15646906 | 0.78 | ALDH1A1 (0.43) | PGK1PGK2ALDH1A1TSHRIDH1 | |
| SCHEMBL8086639 | 0.77 | NPC1 (0.41) | PGK1PGK2ALDH1A1TSHRIDH1 | |
| SCHEMBL8086536 | 0.77 | PTGS2 (0.42) | PGK1PGK2ALDH1A1TSHRKDM4E | |
| SCHEMBL396658 | 0.77 | PGK1 (0.42) | TPMTPGK1PGK2ALDH1A1TSHR | |
| SCHEMBL9026835 | 0.76 | RAPGEF4 (0.36) | ALDH1A1L3MBTL1 | |
| SCHEMBL8053823 | 0.76 | HRH3 (0.47) | PGK1PGK2KDM4ECYP11B1CYP11B2 | |
| SCHEMBL1804197 | 0.75 | TAAR1 (0.63) | NR3C2TAAR1KMT2A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109537763-A | Prefabricated aeroge composite thermal-insulating wall and preparation method thereof | 北京建工新型建材科技股份有限公司 | 2019-03-29 | — | — | CN | claimed |
| EP-1263755-A2 | CYCLIC BETA-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEASES AND TNF-ALPHA | Bristol-Myers Squibb Pharma Company (US) | 2002-12-11 | — | — | EP | disclosed |
| WO-2001070673-A2 | CYCLIC β-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEASES AND TNF-$g(a) | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2001-09-27 | — | — | WO | disclosed |
| EP-0191394-B1 | ISOTHIOUREAS, PROCESS FOR THEIR PREPARATION AND THEIR USE TO COMBAT UNDESIRABLE PLANT GROWTH | BASF Aktiengesellschaft (DE) | 1989-12-06 | — | — | EP | disclosed |
| US-4689068-A | HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1987-08-25 | — | — | US | disclosed |
| EP-0191394-A1 | Isothioureas, process for their preparation and their use to combat undesirable plant growth | BASF Aktiengesellschaft (DE) | 1986-08-20 | — | — | EP | disclosed |