Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.42 |
| ▸ | PNMT | P11086 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | HTR2B | P41595 | 2/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8539519 | 0.89 | GABRA1 (0.50) | GABRA1GABRB2PNMTTAAR1SLC6A2 | |
| SCHEMBL24819489 | 0.81 | HTR2A (0.48) | GABRA1GABRB2SIGMAR1CYP2A6HTR2A | |
| SCHEMBL22579846 | 0.81 | TAAR1 (0.48) | PNMTTAAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL9248105 | 0.80 | HTR2A (0.44) | GABRA1GABRB2PNMTTAAR1SLC6A2 | |
| SCHEMBL28486515 | 0.79 | GABRA1 (0.40) | GABRA1GABRB2PNMTTAAR1SLC6A2 | |
| SCHEMBL27209026 | 0.79 | TDP1 (0.46) | GABRA1GABRB2PNMTTAAR1SLC6A2 | |
| SCHEMBL7528532 | 0.79 | GABRA1 (0.40) | GABRA1GABRB2PNMTTAAR1SLC6A2 | |
| SCHEMBL19368039 | 0.79 | GABRA1 (0.44) | GABRA1GABRB2PNMTTAAR1SLC6A2 | |
| SCHEMBL13430091 | 0.79 | IDO1 (0.46) | PNMTTAAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL20353178 | 0.79 | PNMT (0.69) | PNMTTAAR1SLC6A2SLC6A4SIGMAR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020205564-A1 | CYTOTOXIC BIS-BENZODIAZEPINE DERIVATIVES AND CONJUGATES THEREOF WITH CELL-BINDING AGENTS FOR INHIBITING ABNORMAL CELL GROWTH OR FOR TREATING PROLIFERATIVE DISEASES | IMMUNOGEN, INC. (US) | 2020-10-08 | — | — | WO | disclosed |