Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PTPRB | P23467 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 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 | |
|---|---|---|---|---|
| SCHEMBL9788255 | 0.82 | KDM4E (0.47) | CA1TSHRKDM4EPOLBPTPRB | |
| SCHEMBL9788219 | 0.78 | POLB (0.54) | CA1CA2CA9TSHRKDM4E | |
| SCHEMBL16585088 | 0.78 | TSHR (0.44) | CA1CA2CA9TSHRKDM4E | |
| SCHEMBL9277207 | 0.77 | TSHR (0.42) | CA1CA2CA9TSHRKDM4E | |
| SCHEMBL27571883 | 0.73 | TSHR (0.60) | CA1CA2CA9TSHRNPC1 | |
| SCHEMBL9788235 | 0.73 | TSHR (0.39) | CA1CA2CA9TSHRKDM4E | |
| SCHEMBL21239582 | 0.72 | TSHR (0.48) | CA1CA2CA9TSHRKDM4E | |
| SCHEMBL5873341 | 0.72 | TSHR (0.52) | CA1CA2CA9TSHRNPC1 | |
| SCHEMBL9276273 | 0.72 | TSHR (0.44) | CA1CA2CA9TSHRTACR1 | |
| SCHEMBL249386 | 0.71 | CA2 (0.63) | CA1CA2CA9TSHRPOLB |
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-4985582-A | CHEMICAL INTERMEDIATES FOR BICYCLIC RING COMPOUNDS HAVING MULTIPLE SULFUR ATOMS IN THE RING SYSTEM | THE WELLCOME FOUNDATION LTD. (GB) | 1991-01-15 | — | — | US | disclosed |
| EP-0216625-A2 | Pesticidal compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1987-04-01 | — | — | EP | disclosed |