Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.60 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.56 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 3/20 | 0.43 |
| ▸ | IDO1 | P14902 | 3/20 | 0.43 |
| ▸ | AGXT | P21549 | 2/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31648185 | 0.87 | SLC6A4 (0.52) | SLC6A4SLC6A2SLC6A3TAAR1CYP2D6 | |
| Hydrochloric Acid SCHEMBL31648401 | 0.86 | SLC6A4 (0.50) | SLC6A4SLC6A2SLC6A3TAAR1CYP2D6 | |
| SCHEMBL9921946 | 0.79 | SLC6A4 (0.78) | SLC6A4SLC6A2SLC6A3TAAR1CYP2D6 | |
| SCHEMBL3441646 | 0.79 | SLC6A4 (0.78) | SLC6A4SLC6A2SLC6A3TAAR1CYP2D6 | |
| SCHEMBL29129809 | 0.79 | SLC6A4 (0.58) | SLC6A4SLC6A2SLC6A3TAAR1CYP2D6 | |
| SCHEMBL9129267 | 0.79 | SLC6A4 (0.52) | SLC6A4SLC6A2SLC6A3TAAR1CYP2D6 | |
| Hydrochloric Acid SCHEMBL4291748 | 0.77 | SLC6A4 (0.75) | SLC6A4SLC6A2SLC6A3TAAR1CYP2D6 | |
| Hydrochloric Acid SCHEMBL4291743 | 0.77 | SLC6A4 (0.75) | SLC6A4SLC6A2SLC6A3TAAR1CYP2D6 | |
| SCHEMBL29498029 | 0.77 | SLC6A4 (0.56) | SLC6A4SLC6A2SLC6A3TAAR1CYP2D6 | |
| SCHEMBL232629 | 0.77 | SLC6A2 (0.63) | SLC6A4SLC6A2SLC6A3TAAR1CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-6890942-B2 | Acyl sulfonamides as inhibitors of HIV integrase | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-05-10 | — | — | US | disclosed |
| US-20050004232-A1 | Acyl sulfonamides as inhibitors of HIV integrase | BRISTOL-MYERS SQUIBB COMPANY | 2005-01-06 | — | — | US | disclosed |
| WO-2004103278-A2 | ACYL SULFONAMIDES AS INHIBITORS OF HIV INTEGRASE | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-12-02 | — | — | WO | 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-20050004232-A1 | Acyl sulfonamides as inhibitors of HIV integrase | ACSS2, ARSA, ASS1 | SLC6A4 3732/4885SLC6A2 3628/4885SLC6A3 3002/4885 |
“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.