Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.33 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.33 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.33 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.33 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.33 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.33 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.33 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8185669 | 0.80 | GPR35 (0.51) | TSHRCYP3A4ALDH1A1TDP1LMNA | |
| SCHEMBL2490861 | 0.80 | TDP1 (0.53) | TSHRCYP3A4ALDH1A1TDP1HTT | |
| SCHEMBL2985646 | 0.80 | CYP19A1 (0.40) | TSHRCYP3A4ALDH1A1TDP1HTT | |
| SCHEMBL29465814 | 0.80 | TDP1 (0.53) | TSHRCYP3A4ALDH1A1TDP1HTT | |
| SCHEMBL11838138 | 0.78 | ALDH1A1 (0.51) | TSHRCYP3A4ALDH1A1TDP1HTT | |
| SCHEMBL541077 | 0.78 | PARP1 (0.46) | TSHRCYP3A4ALDH1A1TDP1HTT | |
| SCHEMBL21335376 | 0.78 | EPAS1 (0.44) | TSHRCYP3A4ALDH1A1HTTLMNA | |
| SCHEMBL7383304 | 0.77 | ALDH1A1 (0.51) | ALDH1A1TDP1HTTLMNAMAPT | |
| SCHEMBL31347515 | 0.77 | ALDH1A1 (0.51) | TSHRCYP3A4ALDH1A1TDP1HTT | |
| SCHEMBL4735451 | 0.75 | PDK1 (0.49) | CYP3A4ALDH1A1TDP1HTTLMNA |
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-2007030361-A2 | BENZIMIDAZOLE THIOPHENE COMPOUNDS AS PLK INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-03-15 | — | — | WO | disclosed |