Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 7/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7922097 | 0.89 | CYP1A2 (0.46) | L3MBTL1ALDH1A1LMNAKDM4ESMN1; SMN2 | |
| SCHEMBL7928468 | 0.87 | L3MBTL1 (0.49) | L3MBTL1ALDH1A1LMNAKDM4ESMN1; SMN2 | |
| SCHEMBL23267299 | 0.87 | L3MBTL1 (0.55) | L3MBTL1ALDH1A1LMNAKDM4ESMN1; SMN2 | |
| SCHEMBL7928360 | 0.86 | ALDH1A1 (0.46) | L3MBTL1ALDH1A1LMNAKDM4ESMN1; SMN2 | |
| SCHEMBL7934222 | 0.81 | KDM4E (0.38) | L3MBTL1ALDH1A1LMNAKDM4ESMN1; SMN2 | |
| SCHEMBL23268009 | 0.79 | CYP1A2 (0.48) | L3MBTL1ALDH1A1LMNAKDM4ESMN1; SMN2 | |
| SCHEMBL23267297 | 0.78 | ALDH1A1 (0.50) | L3MBTL1ALDH1A1LMNAKDM4ESMN1; SMN2 | |
| SCHEMBL23131001 | 0.78 | CYP1A2 (0.52) | L3MBTL1ALDH1A1LMNAKDM4ESMN1; SMN2 | |
| SCHEMBL19456536 | 0.78 | ALDH1A1 (0.50) | L3MBTL1ALDH1A1LMNAKDM4ESMN1; SMN2 | |
| SCHEMBL16667608 | 0.77 | CYP1A2 (0.60) | L3MBTL1ALDH1A1LMNAKDM4ESMN1; SMN2 |
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 |