Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.59 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 4/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.59 |
| ▸ | MEN1 | O00255 | 4/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | CASP3 | P42574 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5051826 | 0.87 | KDR (0.68) | KDRCHEK1RAB9AKDM4EMAPT | |
| Methane SCHEMBL28704887 | 0.85 | KDR (0.66) | KDRCHEK1RAB9AKDM4EMAPT | |
| Benzene SCHEMBL27629233 | 0.85 | RAB9A (0.69) | KDRCHEK1RAB9AKDM4EMAPT | |
| SCHEMBL10176240 | 0.82 | KDR (0.61) | KDRCHEK1RAB9AKDM4EMAPT | |
| SCHEMBL374022 | 0.80 | RAB9A (0.74) | KDRCHEK1RAB9AKDM4EMAPT | |
| SCHEMBL29631691 | 0.80 | RAB9A (0.74) | KDRCHEK1RAB9AKDM4EMAPT | |
| SCHEMBL31544438 | 0.80 | KDR (0.59) | KDRCHEK1RAB9AKDM4EMAPT | |
| SCHEMBL31544439 | 0.80 | KDR (0.59) | KDRCHEK1RAB9AKDM4EMAPT | |
| SCHEMBL31544442 | 0.80 | KDR (0.59) | KDRCHEK1RAB9AKDM4EMAPT | |
| SCHEMBL29727516 | 0.80 | KDR (0.60) | KDRCHEK1RAB9AKDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0939632-B1 | NON-PEPTIDYL VASOPRESSIN V1a ANTAGONISTS | LILLY CO ELI (US) | 2005-10-05 | — | — | EP | disclosed |