Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.59 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 2/20 | 0.55 |
| ▸ | CA2 | P00918 | 2/20 | 0.55 |
| ▸ | MAOA | P21397 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | GSK3B | P49841 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3433075 | 0.89 | CA2 (0.67) | LMNAMAPTHTTSRD5A2CA1 | |
| SCHEMBL28578951 | 0.84 | PARP15 (0.66) | TSHRLMNAMAPTHTTNLRP3 | |
| SCHEMBL20547722 | 0.82 | GSK3B (0.59) | TSHRLMNAMAPTHTTNLRP3 | |
| SCHEMBL11445310 | 0.82 | VNN1 (0.61) | SRD5A2MAPK1GSK3B | |
| SCHEMBL72752 | 0.82 | — | — | |
| Water SCHEMBL27942269 | 0.82 | MAOA (0.73) | TSHRLMNAMAPTHTTNLRP3 | |
| SCHEMBL10697158 | 0.82 | SRD5A2 (0.80) | TSHRLMNAMAPTHTTSRD5A2 | |
| SCHEMBL51827 | 0.82 | SRD5A2 (0.80) | TSHRLMNAMAPTHTTSRD5A2 | |
| SCHEMBL9065412 | 0.82 | SRD5A2 (0.80) | TSHRLMNAMAPTHTTSRD5A2 | |
| SCHEMBL1681512 | 0.82 | SRD5A2 (0.80) | TSHRLMNAMAPTHTTSRD5A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5112851-A | Agricultural Fungicides | SANDOZ LTD. (CH) | 1992-05-12 | — | — | US | disclosed |
| US-4939148-A | Amine derivatives, processes for their production and their use | SANDOZ, LTD. (CH) | 1990-07-03 | — | — | US | disclosed |
| US-4208425-A | VIRICIDES | STERLING DRUG INC. (US) | 1980-06-17 | — | — | US | disclosed |
| US-4171371-A | Diketones | STERLING DRUG INC. (US) | 1979-10-16 | — | — | US | disclosed |
| US-4153719-A | Aromatic diketones | STERLING DRUG INC. (US) | 1979-05-08 | — | — | US | disclosed |