Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.31 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.31 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.31 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL7922012 | 0.81 | ALDH1A1 (0.44) | NQO1TSHRTDP1SMN1; SMN2MAPT | |
| SCHEMBL4529542 | 0.77 | NQO1 (0.64) | NQO1LTA4HTSHRTDP1PARP10 | |
| SCHEMBL6341253 | 0.76 | THRA (0.48) | NQO1LTA4HTDP1SMN1; SMN2L3MBTL1 | |
| SCHEMBL6352416 | 0.75 | ALDH1A1 (0.42) | NQO1LTA4HSMN1; SMN2L3MBTL1 | |
| SCHEMBL2414188 | 0.72 | KDM4E (0.44) | NPC1RAB9ASMN1; SMN2L3MBTL1MAPT | |
| SCHEMBL7928362 | 0.70 | CA1 (0.37) | NQO1LTA4HTSHRTDP1NPC1 | |
| SCHEMBL2772370 | 0.70 | LTA4H (0.55) | LTA4HTSHRRAB9ASMN1; SMN2 | |
| Ether SCHEMBL27558445 | 0.70 | LTA4H (0.41) | LTA4HTSHRTDP1NPC1RAB9A | |
| SCHEMBL2413751 | 0.70 | LTA4H (0.55) | LTA4HTSHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5657236 | 0.68 | LMNA (0.45) | LTA4HTSHRSMN1; SMN2L3MBTL1MAPT |
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-1140896-A1 | BENZOTHIEPIN-ANILIDE DERIVATIVES, THEIR PRODUCTION AND THEIR USE FOR ANTAGONIZING CCR-5 | Takeda Chemical Industries, Ltd. (JP) | 2001-10-10 | — | — | EP | disclosed |
| US-6235771-B1 | AIDS THERPAY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-05-22 | — | — | US | disclosed |
| WO-2000037455-A1 | BENZOTHIEPIN-ANILIDE DERIVATIVES, THEIR PRODUCTION AND THEIR USE FOR ANTAGONIZING CCR-5 | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2000-06-29 | — | — | WO | disclosed |