Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.61 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.55 |
| ▸ | MIF | P14174 | 2/20 | 0.51 |
| ▸ | IDO1 | P14902 | 2/20 | 0.50 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.50 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.50 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.50 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.50 |
| ▸ | ABL1 | P00519 | 1/20 | 0.50 |
| ▸ | PRKACA | P17612 | 1/20 | 0.50 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.50 |
| ▸ | AKT1 | P31749 | 1/20 | 0.50 |
| ▸ | AKT2 | P31751 | 1/20 | 0.50 |
| ▸ | CLK2 | P49760 | 1/20 | 0.50 |
| ▸ | GSK3A | P49840 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.50 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.50 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL30063565 | 0.86 | LTA4H (0.52) | TAAR1NR3C2MIFIDO1CHEK1 | |
| SCHEMBL27706452 | 0.81 | TAAR1 (0.59) | TAAR1NR3C2MIFIDO1DAO | |
| SCHEMBL3624339 | 0.79 | TAAR1 (0.67) | TAAR1MIFIDO1DAOHTR2A | |
| SCHEMBL9588462 | 0.79 | HTR2A (0.50) | TAAR1NR3C2MIFIDO1CHEK1 | |
| SCHEMBL23178028 | 0.79 | TAAR1 (0.61) | TAAR1MIFIDO1DAOHTR2A | |
| SCHEMBL17894212 | 0.79 | TAAR1 (0.61) | TAAR1NR3C2MIFIDO1DAO | |
| SCHEMBL30777700 | 0.79 | TAAR1 (0.61) | TAAR1NR3C2MIFIDO1DAO | |
| SCHEMBL25949968 | 0.79 | TAAR1 (0.61) | TAAR1MIFIDO1DAOHTR2A | |
| SCHEMBL29278401 | 0.79 | TAAR1 (0.61) | TAAR1NR3C2MIFIDO1DAO | |
| SCHEMBL11383498 | 0.78 | TAAR1 (0.65) | TAAR1MIFIDO1DAOHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0854870-A4 | SUBSTITUTED IMIDAZOLES HAVING ANTI-CANCER AND CYTOKINE INHIBITORY ACTIVITY | MERCK & CO INC (US) | 1999-01-07 | — | — | EP | disclosed |
| EP-0854870-A1 | SUBSTITUTED IMIDAZOLES HAVING ANTI-CANCER AND CYTOKINE INHIBITORY ACTIVITY | Merck & Co., Inc. (US) | 1998-07-29 | — | — | EP | disclosed |
| WO-1997012876-A1 | SUBSTITUTED IMIDAZOLES HAVING ANTI-CANCER AND CYTOKINE INHIBITORY ACTIVITY | MERCK & CO., INC. (US) | 1997-04-10 | — | — | WO | disclosed |