Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.33 |
| ▸ | TACR1 | P25103 | 2/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7738429 | 1.00 | TAS1R3 (0.33) | TAS1R3TAS1R1TACR1MMP1MMP3 | |
| SCHEMBL7739221 | 0.84 | ATM (0.33) | MMP1MMP3CA12CA1CA2 | |
| SCHEMBL7738409 | 0.79 | NOS2 (0.43) | TACR1ATMNOS3NOS1NOS2 | |
| SCHEMBL7738402 | 0.79 | NOS2 (0.43) | TACR1ATMNOS3NOS1NOS2 | |
| SCHEMBL27520737 | 0.76 | TACR1 (0.41) | TACR1CA12CA1CA2CA3 | |
| SCHEMBL7738442 | 0.73 | TACR1 (0.46) | TACR1ALDH1A1CYP2C9CYP2C19POLB | |
| SCHEMBL7738440 | 0.73 | TACR1 (0.46) | TACR1ALDH1A1CYP2C9CYP2C19POLB | |
| SCHEMBL6872787 | 0.73 | ALDH1A1 (0.38) | TAS1R3TAS1R1TACR1CA12CA1 | |
| SCHEMBL7738432 | 0.71 | MEN1 (0.30) | ALDH1A1 | |
| SCHEMBL7738417 | 0.69 | MEN1 (0.39) | ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6416861-B1 | COMBINATORIAL CHEMISTRY | NORTHWESTERN UNIVERSITY | 2002-07-09 | — | — | US | disclosed |
| WO-2000049022-A2 | ORGANOSILICON COMPOUNDS AND USES THEREOF | NORTHWESTERN UNIVERSITY (US) | 2000-08-24 | — | — | WO | disclosed |