Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 4/20 | 0.35 |
| ▸ | HTR2A | P28223 | 3/20 | 0.31 |
| ▸ | HTR2C | P28335 | 3/20 | 0.31 |
| ▸ | HTR2B | P41595 | 3/20 | 0.31 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.30 |
| ▸ | CFTR | P13569 | 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 | |
|---|---|---|---|---|
| SCHEMBL7903478 | 0.78 | PNMT (0.31) | PNMT | |
| SCHEMBL7391096 | 0.71 | CD44 (0.34) | PNMTHTR2AHTR2C | |
| SCHEMBL7391102 | 0.71 | CD44 (0.34) | PNMTHTR2AHTR2C | |
| SCHEMBL25153140 | 0.62 | PNMT (0.40) | PNMT | |
| SCHEMBL31418892 | 0.62 | PNMT (0.40) | PNMT | |
| SCHEMBL8844177 | 0.60 | SLC6A2 (0.33) | HTR2C | |
| SCHEMBL31739077 | 0.60 | PNMT (0.51) | PNMTHTR2AHTR2CHTR2B | |
| SCHEMBL5064557 | 0.59 | HTR2C (0.37) | PNMTHTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL31739038 | 0.59 | PNMT (0.50) | PNMTHTR2AHTR2CHTR2B | |
| SCHEMBL13871750 | 0.58 | PTPN5 (0.47) | PTPN5CFTR |
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-6201119-B1 | 2,3,4,5-TETRAHYDRO-1H-1,4-BENZODIAZEPIN-9-AMINE COMPOUNDS USEFUL AS INTERMEDIATES TO ANTIVIRALS | JANSSEN PHARMACEUTICA N.V. (BE) | 2001-03-13 | — | — | US | disclosed |
| US-5371079-A | Administering to inhibit replication of HIV-1 in human cells | JANSSEN PHARMACEUTICA N.V. (BE) | 1994-12-06 | — | — | US | disclosed |
| US-5270464-A | Anti-HIV-1 tetrahydroimidazo[1,4]benzodiazepin-2-(thi) ones | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-12-14 | — | — | US | disclosed |