Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.64 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.64 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | MMP2 | P08253 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CNR1 | P21554 | 2/20 | 0.47 |
| ▸ | CNR2 | P34972 | 2/20 | 0.47 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5598264 | 0.84 | RAB9A (0.54) | TAS1R3TAS1R1P2RX7ALDH1A1KDM4E | |
| SCHEMBL13164091 | 0.84 | NPC1 (0.64) | TAS1R3TAS1R1P2RX7RAB9ANPC1 | |
| SCHEMBL13164076 | 0.84 | NPC1 (0.64) | TAS1R3TAS1R1P2RX7RAB9ANPC1 | |
| SCHEMBL8852937 | 0.83 | RPS6KB1 (0.51) | TAS1R3TAS1R1P2RX7ALDH1A1KDM4E | |
| SCHEMBL507861 | 0.82 | EPHX2 (0.50) | TAS1R3TAS1R1P2RX7RAB9ANPC1 | |
| SCHEMBL5115018 | 0.81 | P2RX7 (0.55) | TAS1R3TAS1R1P2RX7ALDH1A1GAA | |
| SCHEMBL5552200 | 0.81 | P2RX7 (0.55) | TAS1R3TAS1R1P2RX7ALDH1A1GAA | |
| SCHEMBL5451054 | 0.80 | POLB (0.62) | P2RX7ALDH1A1KDM4EGAARAB9A | |
| SCHEMBL27666303 | 0.79 | TAS1R3 (0.55) | TAS1R3TAS1R1ALDH1A1RAB9ANPC1 | |
| SCHEMBL27666301 | 0.79 | TAS1R3 (0.55) | TAS1R3TAS1R1ALDH1A1RAB9ANPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7241759-B2 | Benzo[1,2,5]thiadiazole compounds | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-07-10 | — | — | US | disclosed |