Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 3/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.60 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.60 |
| ▸ | CES2 | O00748 | 2/20 | 0.59 |
| ▸ | CES1 | P23141 | 2/20 | 0.59 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.53 |
| ▸ | GSK3B | P49841 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.50 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.50 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | KDM1A | O60341 | 1/20 | 0.48 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL648641 | 0.89 | SRD5A2 (0.83) | SRD5A2CES2CES1EPHX2GSK3B | |
| Hydrochloric Acid SCHEMBL27733522 | 0.87 | SRD5A2 (0.79) | SRD5A2CES2CES1EPHX2GSK3B | |
| SCHEMBL15685930 | 0.87 | SRD5A2 (0.53) | SRD5A2ALDH1A1LMNACYP1A1CYP1B1 | |
| SCHEMBL15686207 | 0.86 | SRD5A2 (0.61) | SRD5A2ALDH1A1LMNACYP1A1CYP1B1 | |
| SCHEMBL28558518 | 0.86 | SRD5A2 (0.61) | SRD5A2ALDH1A1LMNACYP1A1CYP1B1 | |
| SCHEMBL28000964 | 0.83 | SRD5A2 (0.73) | SRD5A2CES2CES1EPHX2GSK3B | |
| SCHEMBL13410662 | 0.83 | SRD5A2 (0.73) | SRD5A2CES2CES1EPHX2GSK3B | |
| SCHEMBL18644438 | 0.82 | CYP1A1 (0.55) | SRD5A2ALDH1A1LMNACYP1A1CYP1B1 | |
| SCHEMBL15470661 | 0.82 | CYP1A1 (0.55) | SRD5A2ALDH1A1LMNACYP1A1CYP1B1 | |
| SCHEMBL52200 | 0.82 | ALDH1A1 (1.00) | SRD5A2ALDH1A1LMNACES2CES1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108707056-B | Synthetic method of ketone compound | 广东工业大学 | 2021-11-26 | — | — | CN | disclosed |
| US-9298088-B2 | Fluorinated photopolymer with fluorinated sensitizer | ORTHOGONAL, INC. (US) | 2016-03-29 | — | — | US | disclosed |
| US-20150030982-A1 | FLUORINATED PHOTOPOLYMER WITH FLUORINATED SENSITIZER | ORTHOGONAL, INC. | 2015-01-29 | — | — | US | disclosed |
| US-5017730-A | Process of preparing bis (trifluoromethylphenyl) methanol | CENTRAL GLASS COMPANY, LIMITED (JP) | 1991-05-21 | — | — | US | disclosed |