Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | BCR | P11274 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 6/20 | 0.42 |
| ▸ | RAB9A | P51151 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11860130 | 0.94 | NPC1 (0.46) | ABL1ABCB1BCRNPC1RAB9A | |
| Perchlorate SCHEMBL11867107 | 0.83 | RAB9A (0.36) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| Perchlorate SCHEMBL11876177 | 0.82 | CYP1A2 (0.46) | ABL1ABCB1BCRNPC1RAB9A | |
| Perchlorate SCHEMBL11873006 | 0.81 | NPC1 (0.42) | ABL1ABCB1BCRNPC1RAB9A | |
| Perchlorate SCHEMBL11877376 | 0.80 | PTGS2 (0.37) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| Perchlorate SCHEMBL11870697 | 0.80 | MEN1 (0.38) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| Perchlorate SCHEMBL11864779 | 0.77 | HSD17B1 (0.40) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| Perchlorate SCHEMBL6810519 | 0.77 | ALDH1A1 (0.41) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| Perchlorate SCHEMBL7741224 | 0.76 | ABL1 (0.50) | ABL1ABCB1BCRNPC1RAB9A | |
| Perchlorate SCHEMBL9174324 | 0.75 | KDM4E (0.45) | ABL1ABCB1BCRNPC1RAB9A |
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-3953433-A | REACTION PRODUCT COMPRISING BENZOPYRYLIUM SALT AND BENZOPYRAN | RICOH CO., LTD. (JA) | 1976-04-27 | — | — | US | claimed |
| US-6807138-B1 | Light drive | TRANSPECTRAL SYSTEM LLC | 2004-10-19 | — | — | US | disclosed |