Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 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 | |
|---|---|---|---|---|
| SCHEMBL22820241 | 0.90 | TSHR (0.40) | TSHRTACR1ALDH1A1CA1CA2 | |
| SCHEMBL26554533 | 0.88 | TSHR (0.41) | TSHRTACR1ALDH1A1CA1CA2 | |
| SCHEMBL213520 | 0.86 | TSHR (0.45) | TSHRTACR1MMP2MMP3MMP9 | |
| SCHEMBL5555166 | 0.83 | TSHR (0.45) | TSHRTACR1ALDH1A1CA1CA2 | |
| SCHEMBL26561131 | 0.81 | TSHR (0.38) | TSHRTACR1ALDH1A1CA1CA2 | |
| SCHEMBL754280 | 0.80 | TSHR (0.50) | TSHRTACR1ALDH1A1CA1CA2 | |
| SCHEMBL11711887 | 0.79 | TSHR (0.39) | TSHRTACR1ALDH1A1HTR2BTMEM97 | |
| SCHEMBL26561319 | 0.79 | DGAT1 (0.43) | HTR2BTMEM97SIGMAR1MMP2LMNA | |
| SCHEMBL28001128 | 0.79 | TSHR (0.41) | TSHRTACR1ALDH1A1TAAR1LMNA | |
| SCHEMBL13824550 | 0.78 | CHRM3 (0.39) | TSHRTACR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0211598-B1 | Pesticidal compounds | WELLCOME FOUND (GB) | 1993-12-15 | — | — | EP | disclosed |
| US-5098929-A | Insecticides, insect attractants, fungicides or oxidase inhibitors | THE WELLCOME FOUNDATION LIMITED (GB) | 1992-03-24 | — | — | US | disclosed |
| EP-0211598-A2 | Pesticidal compounds | ROUSSEL-UCLAF (FR) | 1987-02-25 | — | — | EP | disclosed |