Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9058700 | 0.70 | KMT2A (0.56) | TDP1ALDH1A1MAPK1HPGDTP53 | |
| SCHEMBL9854189 | 0.66 | USP2 (0.30) | TDP1NPSR1 | |
| SCHEMBL8575765 | 0.63 | GAA (0.47) | ALDH1A1L3MBTL1LMNAKMT2A | |
| SCHEMBL29352673 | 0.61 | CYP1A2 (0.73) | TDP1ALDH1A1MAPK1HPGDTSHR | |
| SCHEMBL11668426 | 0.61 | PDK1 (0.54) | ALDH1A1TP53TSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL54175 | 0.61 | CYP1A2 (0.73) | TDP1ALDH1A1MAPK1HPGDTSHR | |
| SCHEMBL8887013 | 0.61 | CYP1A2 (0.73) | TDP1ALDH1A1MAPK1HPGDTSHR | |
| SCHEMBL8669334 | 0.61 | KMT2A (0.37) | TDP1ALDH1A1MAPK1HPGDTP53 | |
| SCHEMBL7624765 | 0.61 | ALDH1A1 (0.30) | TDP1ALDH1A1MAPK1HPGDTP53 | |
| SCHEMBL1724327 | 0.58 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4143043-A | MICROBIOCIDES | THE DOW CHEMICAL COMPANY (US) | 1979-03-06 | — | — | US | disclosed |
| US-4094880-A | BACTERICIDES AND FUNGICIDES | THE DOW CHEMICAL COMPANY (US) | 1978-06-13 | — | — | US | disclosed |