Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 2/20 | 0.40 |
| ▸ | METAP1 | P53582 | 2/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | SREBF2 | Q12772 | 1/20 | 0.37 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 5/20 | 0.36 |
| ▸ | RAB9A | P51151 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL679707 | 0.82 | SCN9A (0.47) | METAP2METAP1SCN9AKAT6AESR1 | |
| Methane SCHEMBL27495181 | 0.80 | ALDH1A1 (0.47) | METAP2METAP1SCN9AKAT6AESR1 | |
| SCHEMBL4640169 | 0.80 | TSHR (0.59) | METAP2METAP1SCN9ASREBF2KAT6A | |
| Benzene SCHEMBL27628092 | 0.74 | KDM4E (0.46) | ALDH1A1KDM4ECYP1A2CYP2D6CYP2C19 | |
| SCHEMBL5978656 | 0.73 | ALDH1A1 (0.67) | ALDH1A1KDM4ETSHRCYP1A2CYP2D6 | |
| SCHEMBL27732241 | 0.73 | KAT6A (0.49) | METAP2METAP1SCN9AKAT6AESR1 | |
| SCHEMBL11567188 | 0.72 | KDM4E (0.44) | ALDH1A1NPC1RAB9AKDM4ECYP3A4 | |
| SCHEMBL7492735 | 0.72 | KAT6A (0.43) | METAP2METAP1SCN9AKAT6AESR1 | |
| SCHEMBL5068498 | 0.72 | — | — | |
| SCHEMBL104484 | 0.72 | — | — |
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-5514809-A | METHINE DYES; BENZOTHIAZOLE DERIVATIVES; SENSITIZERS; AGING PRESERVABILITY | FUJI PHOTO FILM CO., LTD. (JP) | 1996-05-07 | — | — | US | disclosed |