Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 15/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.57 |
| ▸ | NAMPT | P43490 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.47 |
| ▸ | TUBB | P07437 | 1/20 | 0.47 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.47 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.47 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.47 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.47 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.47 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.47 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.47 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.47 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.47 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.47 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.47 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.47 |
| ▸ | TUBB1 | Q9H4B7 | 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 | |
|---|---|---|---|---|
| SCHEMBL9034050 | 0.93 | CNR1 (0.66) | CNR1PTGS2CNR2POLBTUBB4A | |
| SCHEMBL8938527 | 0.85 | TUBB4A (0.53) | CNR1PTGS2POLBTUBB4ATUBB | |
| SCHEMBL8938466 | 0.83 | CNR1 (0.49) | CNR1PTGS2CNR2POLBTUBB4A | |
| SCHEMBL8938481 | 0.83 | TUBB (0.53) | CNR1PTGS2TUBB4ATUBBTUBA3C | |
| SCHEMBL8938285 | 0.83 | CNR1 (0.49) | CNR1PTGS2CNR2POLBTUBB4A | |
| SCHEMBL8938522 | 0.82 | NAMPT (0.55) | NAMPTTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL8938242 | 0.82 | TUBB4A (0.46) | CNR1PTGS2NAMPTPOLBTUBB4A | |
| SCHEMBL8938511 | 0.82 | TUBB4A (0.56) | CNR1PTGS2POLBTUBB4ATUBB | |
| SCHEMBL9034380 | 0.82 | PTGS2 (0.52) | CNR1PTGS2POLBTUBB4ATUBB | |
| SCHEMBL9033484 | 0.81 | NAMPT (0.46) | CNR1PTGS2NAMPTPOLBTUBB4A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5527819-A | TREATING AIDS | MERCK & CO., INC. (US) | 1996-06-18 | — | — | US | disclosed |
| EP-0686148-A4 | INHIBITORS OF HIV REVERSE TRANSCRIPTASE | MERCK & CO INC (US) | 1996-02-07 | — | — | EP | disclosed |
| EP-0686148-A1 | INHIBITORS OF HIV REVERSE TRANSCRIPTASE | MERCK & CO. INC. (US) | 1995-12-13 | — | — | EP | disclosed |
| WO-1994019321-A1 | INHIBITORS OF HIV REVERSE TRANSCRIPTASE | MERCK & CO., INC. (US) | 1994-09-01 | — | — | WO | disclosed |