Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11852807 | 0.83 | EPHX1 (0.47) | KMT2AEPHX1TSHRCYP1A2PKM | |
| SCHEMBL9189904 | 0.78 | CHRM1 (0.57) | KMT2ACHRM1TSHRCHRM4CHRM3 | |
| SCHEMBL5277965 | 0.74 | ALDH1A1 (0.52) | KMT2ACHRM1KDM4ETSHRCHRM4 | |
| SCHEMBL11780897 | 0.73 | KDM4E (0.57) | KMT2ACHRM1KDM4ETSHRCHRM4 | |
| SCHEMBL8443134 | 0.71 | KMT2A (0.51) | KMT2ACHRM1KDM4EEPHX1PKM | |
| SCHEMBL279780 | 0.71 | KDM4E (0.49) | KMT2ACHRM1KDM4ETSHRCYP1A2 | |
| SCHEMBL11780904 | 0.70 | KDM4E (0.55) | KMT2ACHRM1KDM4ETSHRCHRM4 | |
| Hydrochloric Acid SCHEMBL28014865 | 0.69 | KMT2A (0.42) | KMT2AKDM4ETSHRCYP1A2CYP2D6 | |
| SCHEMBL7862688 | 0.69 | LMNA (0.46) | KMT2ACHRM1TSHRCHRM4CHRM3 | |
| SCHEMBL11252374 | 0.69 | KMT2A (0.49) | KMT2ACHRM1KDM4EEPHX1CYP1A2 |
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-3991051-A | ANTIBIOTICS | E. R. SQUIBB & SONS, INC. (US) | 1976-11-09 | — | — | US | disclosed |
| US-3989696-A | 3-Heterothio[(oxyalkyl)thioacetyl]cephalosporin derivatives | E. R. SQUIBB & SONS, INC. (US) | 1976-11-02 | — | — | US | disclosed |