Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 3/20 | 0.70 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | GUSB | P08236 | 2/20 | 0.46 |
| ▸ | FABP3 | P05413 | 1/20 | 0.45 |
| ▸ | FABP4 | P15090 | 1/20 | 0.45 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 3/20 | 0.45 |
| ▸ | SMPD3 | Q9NY59 | 3/20 | 0.44 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4740751 | 0.87 | GUSB (0.59) | DHODHCYP1A1CYP1B1CYP1A2GUSB | |
| SCHEMBL696548 | 0.83 | DHODH (0.56) | DHODHCYP1A2PARP1KMT2AKDM4E | |
| SCHEMBL505197 | 0.82 | DHODH (1.00) | DHODHPARP1 | |
| SCHEMBL28116288 | 0.81 | PARP1 (0.53) | DHODHCYP1A1CYP1B1CYP1A2GUSB | |
| SCHEMBL505569 | 0.80 | DHODH (0.55) | DHODHPARP1KDM4ENPC1ALDH1A1 | |
| SCHEMBL504921 | 0.78 | DHODH (0.67) | DHODHKMT2AKDM4ENPC1ALDH1A1 | |
| SCHEMBL697780 | 0.77 | KDM4E (0.54) | DHODHGUSBPARP1KMT2AKDM4E | |
| SCHEMBL10211823 | 0.76 | DHODH (0.64) | DHODHFABP3FABP4FABP5KMT2A | |
| SCHEMBL6840289 | 0.76 | PIN1 (0.56) | DHODHPARP1KMT2AKDM4ENPC1 | |
| SCHEMBL505582 | 0.76 | DHODH (0.64) | DHODHPARP1KMT2AKDM4EALDH1A1 |
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-9006454-B2 | Dihydroorotate dehydrogenase inhibitors | MERCK SERONO S.A. (CH) | 2015-04-14 | — | — | US | disclosed |
| US-9006454-B2 | Dihydroorotate dehydrogenase inhibitors | MERCK SERONO S.A. (CH) | 2015-04-14 | — | — | US | disclosed |