Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.57 |
| ▸ | CTSL | P07711 | 1/20 | 0.51 |
| ▸ | CTSB | P07858 | 1/20 | 0.51 |
| ▸ | CTSS | P25774 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 1/20 | 0.51 |
| ▸ | F2 | P00734 | 2/20 | 0.49 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.49 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.49 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.49 |
| ▸ | KDM1A | O60341 | 6/20 | 0.48 |
| ▸ | MAOA | P21397 | 4/20 | 0.48 |
| ▸ | RCOR1 | Q9UKL0 | 3/20 | 0.48 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11269675 | 0.82 | NPSR1 (0.39) | TACR1 | |
| SCHEMBL11269680 | 0.79 | NPSR1 (0.62) | KDM1ARCOR1 | |
| SCHEMBL7370634 | 0.75 | HDAC8 (0.73) | TACR1CTSLCTSBCTSSCTSK | |
| SCHEMBL4171055 | 0.75 | TACR1 (0.61) | TACR1CTSLCTSBCTSSCTSK | |
| SCHEMBL7971421 | 0.73 | TACR1 (1.00) | TACR1CTSLCTSBCTSSCTSK | |
| SCHEMBL13768104 | 0.73 | CTSL (0.61) | TACR1CTSLCTSBCTSSCTSK | |
| SCHEMBL18444606 | 0.73 | KDM1A (0.68) | TACR1CTSLCTSBCTSSCTSK | |
| SCHEMBL8083427 | 0.73 | TACR1 (0.71) | TACR1CTSLCTSBCTSSCTSK | |
| SCHEMBL4157711 | 0.72 | TACR1 (0.67) | TACR1CTSLCTSBCTSSCTSK | |
| SCHEMBL20441472 | 0.72 | CTSL (0.53) | TACR1CTSLCTSBCTSSCTSK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE31071-E | 6-Aza-3H-1,4-benzodiazepines | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) | 1982-11-02 | — | — | US | disclosed |
| US-4008223-A | SPASMOLYTIC, ANTIPHLOGISTIC, TRANQUILIZER | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) | 1977-02-15 | — | — | US | disclosed |