Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | C1R | P00736 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | EIF4E | P06730 | 2/20 | 0.38 |
| ▸ | CTSD | P07339 | 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 | |
|---|---|---|---|---|
| SCHEMBL27688577 | 0.75 | CYP1A2 (0.43) | ALDH1A1TDP1MAPTCYP1A2TSHR | |
| SCHEMBL1287837 | 0.72 | ALDH1A1 (0.74) | ALDH1A1TDP1CYP1A2TSHRMEN1 | |
| SCHEMBL30535903 | 0.72 | ALDH1A1 (0.74) | ALDH1A1TDP1CYP1A2TSHRMEN1 | |
| SCHEMBL4439669 | 0.72 | TSHR (0.59) | ALDH1A1TDP1MAPTLMNAHTT | |
| SCHEMBL29120749 | 0.70 | MAPT (0.57) | ALDH1A1TDP1MAPTLMNAHTT | |
| SCHEMBL29337140 | 0.70 | ALDH1A1 (0.71) | ALDH1A1TDP1CYP1A2TSHRMEN1 | |
| Ammonia Solution, Strong SCHEMBL9060371 | 0.70 | ALDH1A1 (0.71) | ALDH1A1TDP1CYP1A2TSHRMEN1 | |
| SCHEMBL30987815 | 0.70 | ALDH1A1 (0.71) | ALDH1A1TDP1CYP1A2TSHRMEN1 | |
| SCHEMBL74692 | 0.70 | CYP1A2 (0.62) | ALDH1A1LMNACYP1A2TSHRMEN1 | |
| SCHEMBL3535123 | 0.69 | GPR35 (0.54) | ALDH1A1TDP1MAPTCYP1A2TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0915876-A1 | TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS | American Cyanamid Company (US) | 1999-05-19 | — | — | EP | disclosed |
| WO-1997049708-A9 | TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS | — | 1998-05-22 | — | — | WO | disclosed |
| WO-1997049707-A1 | TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS | AMERICAN CYANAMID COMPANY (US) | 1997-12-31 | — | — | WO | disclosed |
| WO-1997049708-A1 | TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS | AMERICAN CYANAMID COMPANY (US) | 1997-12-31 | — | — | WO | disclosed |