Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | THRB | P10828 | 2/20 | 0.61 |
| ▸ | RECQL | P46063 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | CASP1 | P29466 | 2/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.61 |
| ▸ | TNF | P01375 | 1/20 | 0.61 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.61 |
| ▸ | KDR | P35968 | 1/20 | 0.61 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.61 |
| ▸ | CASP7 | P55210 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL2803641 | 0.82 | TDP1 (0.59) | MEN1KMT2AKDM4ETDP1ALDH1A1 | |
| Succinic Acid SCHEMBL175593 | 0.81 | KDM4E (0.53) | MEN1KMT2AKDM4ETDP1ALDH1A1 | |
| Mesalamine SCHEMBL2680201 | 0.79 | KDM4E (0.96) | MEN1KMT2AKDM4ETDP1ALDH1A1 | |
| SCHEMBL11581529 | 0.79 | GAA (0.52) | MEN1KMT2AKDM4ETDP1ALDH1A1 | |
| SCHEMBL11581510 | 0.79 | KMT2A (0.72) | MEN1KMT2AKDM4EHPGDHSD17B10 | |
| SCHEMBL11654727 | 0.79 | HPGD (0.58) | MEN1KMT2AKDM4ETDP1ALDH1A1 | |
| SCHEMBL2935246 | 0.79 | CA1 (0.61) | MEN1KMT2AKDM4EALDH1A1HPGD | |
| SCHEMBL10713704 | 0.78 | ALDH1A1 (0.60) | MEN1KMT2AKDM4ETDP1ALDH1A1 | |
| SCHEMBL11756405 | 0.77 | HTT (0.56) | MEN1KMT2AKDM4ETDP1ALDH1A1 | |
| SCHEMBL11705327 | 0.77 | HTT (0.56) | MEN1KMT2AKDM4ETDP1ALDH1A1 |
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-4111936-A | PYRIDAZINETHIONES | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1978-09-05 | — | — | US | disclosed |
| US-4011321-A | 6-(3-SUBSTITUTED AMINO-2-HYDROXYPROPOXYARYL)-4,5-DIHYDRO-3(2H)-PYRIDAZINONES | SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) | 1977-03-08 | — | — | US | disclosed |