Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MLYCD | O95822 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7956652 | 1.00 | SIGMAR1 (0.37) | SIGMAR1CA1CA2CA12MMP1 | |
| SCHEMBL1683540 | 0.83 | POLB (0.31) | POLBDPP4 | |
| SCHEMBL12161902 | 0.81 | SIGMAR1 (0.35) | SIGMAR1CA1CA2CA12MMP1 | |
| SCHEMBL7574343 | 0.78 | KCNK3 (0.32) | CA1CA2MMP1MMP2ALDH1A1 | |
| SCHEMBL152945 | 0.76 | SIGMAR1 (0.40) | SIGMAR1CA1CA2CA12MMP1 | |
| SCHEMBL9807619 | 0.75 | ADAM17 (0.36) | SIGMAR1ALDH1A1MEN1KMT2A | |
| SCHEMBL6435427 | 0.75 | RIPK1 (0.31) | — | |
| SCHEMBL6435420 | 0.75 | RIPK1 (0.31) | — | |
| SCHEMBL10145220 | 0.74 | SIGMAR1 (0.39) | SIGMAR1CA1CA2CA12MMP1 | |
| SCHEMBL7789744 | 0.72 | CA1 (0.31) | CA1CA2CA7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6313275-B1 | FREE RADICAL CATALYSTS FOR OLEFIN (CO)POLYMERIZATION; ENDCAPPING WITH HETEROCYCLIC GROUPS; BLOCK AND GRAFT POLYMERIZATION | BASF AKTIENGESELLSCHAFT (DE) | 2001-11-06 | — | — | US | disclosed |
| EP-1049681-A1 | AZOIC COMPOUNDS FUNCTIONALIZED WITH HETEROCYCLES | BASF AKTIENGESELLSCHAFT (DE) | 2000-11-08 | — | — | EP | disclosed |
| WO-1999037629-A1 | AZOIC COMPOUNDS FUNCTIONALIZED WITH HETEROCYCLES | BASF AKTIENGESELLSCHAFT (DE) | 1999-07-29 | — | — | WO | disclosed |