Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ODC1 | P11926 | 2/20 | 0.36 |
| ▸ | FDPS | P14324 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | PAOX | Q6QHF9 | 4/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | BLM | P54132 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | PTPRB | P23467 | 4/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | GABRR3 | A8MPY1 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8641534 | 0.98 | LMNA (0.37) | ODC1FDPSPDE3APAOXCYP1A2 | |
| SCHEMBL8633741 | 0.80 | FDPS (0.39) | ODC1FDPSPDE3APAOXCYP1A2 | |
| SCHEMBL13689469 | 0.80 | CYP4F2 (0.40) | ODC1FDPSPDE3APAOXCYP1A2 | |
| SCHEMBL15233853 | 0.79 | EPHX1 (0.39) | FDPSLMNAMAPTPTPRBDGAT1 | |
| SCHEMBL27593964 | 0.78 | ODC1 (0.38) | ODC1FDPSPDE3APAOXCYP1A2 | |
| SCHEMBL8979106 | 0.78 | MEN1 (0.53) | CYP1A2LMNAKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL6595080 | 0.78 | ODC1 (0.38) | ODC1FDPSPDE3APAOXCYP1A2 | |
| SCHEMBL28012765 | 0.78 | ODC1 (0.37) | ODC1FDPSPDE3APAOXCYP1A2 | |
| SCHEMBL7203818 | 0.78 | ODC1 (0.38) | ODC1FDPSPDE3APAOXCYP1A2 | |
| SCHEMBL7203815 | 0.78 | ODC1 (0.38) | ODC1FDPSPDE3APAOXCYP1A2 |
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-5552507-A | DI-(3-ISOCYANATOPROPYL) MALONIC ACID DIESTERS, MONOMERS FOR POLYURETHANES OR POLYUREAS THAT ARE PHOTOSTABLE AND WEATHER RESISTANT | BAYER AKTIENGESELLSCHAFT (DE) | 1996-09-03 | — | — | US | disclosed |