Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.31 |
| ▸ | HTR2A | P28223 | 2/20 | 0.31 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.30 |
| ▸ | GRM2 | Q14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL2113536 | 0.92 | AKR1B1 (0.35) | AKR1B1PIK3CBHSP90AA1HTR2AMDM2 | |
| SCHEMBL4494946 | 0.89 | AKR1B1 (0.33) | AKR1B1PIK3CBHSP90AA1HTR2AHTR2C | |
| SCHEMBL4489874 | 0.87 | AKR1B1 (0.35) | AKR1B1HTR2AFSCN1HDAC1HDAC6 | |
| SCHEMBL31060990 | 0.86 | AKR1B1 (0.36) | AKR1B1PIK3CBHTR2AFSCN1GRM2 | |
| SCHEMBL4479511 | 0.86 | AKR1B1 (0.36) | AKR1B1PIK3CBHTR2AFSCN1GRM2 | |
| SCHEMBL4489034 | 0.86 | AKR1B1 (0.38) | AKR1B1HSP90AA1HTR2AHDAC1HDAC6 | |
| SCHEMBL6032265 | 0.85 | AKR1B1 (0.35) | AKR1B1PIK3CBHTR2AFSCN1HDAC1 | |
| SCHEMBL4481021 | 0.85 | AKR1B1 (0.35) | AKR1B1PIK3CBHSP90AA1HTR2AHTR2C | |
| SCHEMBL4488414 | 0.85 | AKR1B1 (0.35) | AKR1B1PIK3CBHTR2AFSCN1GRM2 | |
| SCHEMBL4483837 | 0.84 | AKR1B1 (0.36) | AKR1B1PIK3CBHTR2AFSCN1GRM2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070179196-A1 | Hiv integrase inhibitors | MERCK SHARP & DOHME CORP. | 2007-08-02 | — | — | US | claimed |
| EP-1725556-A1 | HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (US) | 2006-11-29 | — | — | EP | claimed |
| WO-2005087768-A1 | HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 2005-09-22 | — | — | WO | claimed |
| US-7598264-B2 | HIV integrase inhibitors | MERCK & CO., INC. (US) | 2009-10-06 | — | — | US | disclosed |
| US-20070179196-A1 | Hiv integrase inhibitors | MERCK SHARP & DOHME CORP. | 2007-08-02 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20070179196-A1 | Hiv integrase inhibitors | REV1, TYMP, POLR2H | AKR1B1 2248/4885PIK3CB 259/4885HSP90AA1 2177/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.