Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.65 |
| ▸ | MEN1 | O00255 | 3/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.65 |
| ▸ | TTR | P02766 | 1/20 | 0.65 |
| ▸ | PPOX | P50336 | 1/20 | 0.65 |
| ▸ | LMNA | P02545 | 7/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | PYGL | P06737 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | CCR6 | P51684 | 1/20 | 0.42 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10857874 | 0.90 | TDP1 (0.76) | TDP1MEN1KMT2ATTRPPOX | |
| SCHEMBL10852284 | 0.90 | TDP1 (0.69) | TDP1MEN1KMT2ATTRPPOX | |
| SCHEMBL7814969 | 0.88 | TDP1 (0.83) | TDP1MEN1KMT2ATTRPPOX | |
| SCHEMBL30077264 | 0.88 | TDP1 (0.83) | TDP1MEN1KMT2ATTRPPOX | |
| SCHEMBL11056139 | 0.85 | TDP1 (0.49) | TDP1MEN1KMT2ATTRPPOX | |
| 1,2-Dichloroethane SCHEMBL28901815 | 0.84 | TDP1 (0.77) | TDP1MEN1KMT2ATTRPPOX | |
| SCHEMBL10853469 | 0.84 | TDP1 (0.61) | TDP1MEN1KMT2ATTRPPOX | |
| SCHEMBL11359539 | 0.83 | TDP1 (0.55) | TDP1MEN1KMT2ATTRPPOX | |
| SCHEMBL9768686 | 0.83 | MEN1 (0.55) | TDP1MEN1KMT2ATTRPPOX | |
| SCHEMBL10848998 | 0.82 | MEN1 (0.50) | TDP1MEN1KMT2ATTRPPOX |
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 |
|---|---|---|---|---|---|---|---|
| US-4618359-A | 3-TETRAHYDROFURYL 2-NITRO-5(2-CHLORO-4-TRIFLOROMETHYLPHENOXY)BENZOATE | SANDOZ LTD. (CH) | 1986-10-21 | — | — | US | disclosed |